N-(1H-indol-3-ylmethyl)-2-[(2S,4R,5R)-4-(4-methoxyphenyl)-5-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]piperidin-2-yl]-N-methyl-ethanamide

Systemtic Name: N-(1H-indol-3-ylmethyl)-2-[(2S,4R,5R)-4-(4-methoxyphenyl)-5-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]piperidin-2-yl]-N-methyl-ethanamide Openeye Name: N-(1H-indol-3-ylmethyl)-2-[(2S,4R,5R)-4-(4-methoxyphenyl)-5-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]-2-piperidyl]-N-methyl-acetamide CAS Name: N-(1H-indol-3-ylmethyl)-2-[(2S,4R,5R)-4-(4-methoxyphenyl)-5-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]-2-piperidinyl]-N-methylacetamide IUPAC Name: N-(1H-indol-3-ylmethyl)-2-[(2S,4R,5R)-4-(4-methoxyphenyl)-5-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]piperidin-2-yl]-N-methylacetamide Traditional Name: N-(1H-indol-3-ylmethyl)-2-[(2S,4R,5R)-4-(4-methoxyphenyl)-5-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]-2-piperidyl]-N-methyl-acetamide Formula: C37H46N4O5 MolecularWeight: 626.78494

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CNC2=CC=CC=C21)C(=O)CC3CC(C(CN3)OCC4=CC5=C(C=C4)OCCN5CCCOC)C6=CC=C(C=C6)OC

Isomeric SMILES

CN(CC1=CNC2=CC=CC=C21)C(=O)C[C@@H]3C[C@@H]([C@H](CN3)OCC4=CC5=C(C=C4)OCCN5CCCOC)C6=CC=C(C=C6)OC

InChI

InChI=1S/C37H46N4O5/c1-40(24-28-22-39-33-8-5-4-7-31(28)33)37(42)21-29-20-32(27-10-12-30(44-3)13-11-27)36(23-38-29)46-25-26-9-14-35-34(19-26)41(16-18-45-35)15-6-17-43-2/h4-5,7-14,19,22,29,32,36,38-39H,6,15-18,20-21,23-25H2,1-3H3/t29-,32+,36-/m0/s1