N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-(phenylmethyl)-1,3-benzoxazole-6-carboxamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-(phenylmethyl)-1,3-benzoxazole-6-carboxamide Openeye Name: 2-benzyl-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-1,3-benzoxazole-6-carboxamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-2-(phenylmethyl)-1,3-benzoxazole-6-carboxamide IUPAC Name: 2-benzyl-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-1,3-benzoxazole-6-carboxamide Traditional Name: 2-benzyl-N-[3-[4-(4-methoxyphenyl)piperazino]propyl]-1,3-benzoxazole-6-carboxamide Formula: C29H32N4O3 MolecularWeight: 484.58938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=CC4=C(C=C3)N=C(O4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=CC4=C(C=C3)N=C(O4)CC5=CC=CC=C5

InChI

InChI=1S/C29H32N4O3/c1-35-25-11-9-24(10-12-25)33-18-16-32(17-19-33)15-5-14-30-29(34)23-8-13-26-27(21-23)36-28(31-26)20-22-6-3-2-4-7-22/h2-4,6-13,21H,5,14-20H2,1H3,(H,30,34)