N1-[(2S,4S,5S,7S)-4-azanyl-7-(butylcarbamoyl)-8-methyl-5-oxidanyl-2-propan-2-yl-nonyl]-2-(4-methoxybutoxy)-N1-methyl-benzene-1,4-dicarboxamide

Systemtic Name: N1-[(2S,4S,5S,7S)-4-azanyl-7-(butylcarbamoyl)-8-methyl-5-oxidanyl-2-propan-2-yl-nonyl]-2-(4-methoxybutoxy)-N1-methyl-benzene-1,4-dicarboxamide Openeye Name: N1-[(2S,4S,5S,7S)-4-amino-7-(butylcarbamoyl)-5-hydroxy-2-isopropyl-8-methyl-nonyl]-2-(4-methoxybutoxy)-N1-methyl-terephthalamide CAS Name: N1-[(2S,4S,5S,7S)-4-amino-7-[butylamino(oxo)methyl]-5-hydroxy-8-methyl-2-propan-2-ylnonyl]-2-(4-methoxybutoxy)-N1-methylbenzene-1,4-dicarboxamide IUPAC Name: 1-N-[(2S,4S,5S,7S)-4-amino-7-(butylcarbamoyl)-5-hydroxy-8-methyl-2-propan-2-ylnonyl]-2-(4-methoxybutoxy)-1-N-methylbenzene-1,4-dicarboxamide Traditional Name: N-[(2S,4S,5S,7S)-4-amino-7-(butylcarbamoyl)-5-hydroxy-2-isopropyl-8-methyl-nonyl]-2-(4-methoxybutoxy)-N-methyl-terephthalamide Formula: C32H56N4O6 MolecularWeight: 592.81024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(CC(C(CC(CN(C)C(=O)C1=C(C=C(C=C1)C(=O)N)OCCCCOC)C(C)C)N)O)C(C)C

Isomeric SMILES

CCCCNC(=O)[C@@H](C[C@@H]([C@H](C[C@H](CN(C)C(=O)C1=C(C=C(C=C1)C(=O)N)OCCCCOC)C(C)C)N)O)C(C)C

InChI

InChI=1S/C32H56N4O6/c1-8-9-14-35-31(39)26(22(4)5)19-28(37)27(33)17-24(21(2)3)20-36(6)32(40)25-13-12-23(30(34)38)18-29(25)42-16-11-10-15-41-7/h12-13,18,21-22,24,26-28,37H,8-11,14-17,19-20,33H2,1-7H3,(H2,34,38)(H,35,39)/t24-,26+,27+,28+/m1/s1