methyl 4-[[5-[1-acetyloxy-2-(propylcarbamoyl)butyl]-1-propyl-indol-3-yl]methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[[5-[1-acetyloxy-2-(propylcarbamoyl)butyl]-1-propyl-indol-3-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[5-[1-acetoxy-2-(propylcarbamoyl)butyl]-1-propyl-indol-3-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[5-[1-acetyloxy-2-[oxo(propylamino)methyl]butyl]-1-propyl-3-indolyl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[5-[1-acetyloxy-2-(propylcarbamoyl)butyl]-1-propylindol-3-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[5-[1-acetoxy-2-(propylcarbamoyl)butyl]-1-propyl-indol-3-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C31H40N2O6 MolecularWeight: 536.6591

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(CC)C(C1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)OC)OC)CCC)OC(=O)C

Isomeric SMILES

CCCNC(=O)C(CC)C(C1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)OC)OC)CCC)OC(=O)C

InChI

InChI=1S/C31H40N2O6/c1-7-14-32-30(35)25(9-3)29(39-20(4)34)22-12-13-27-26(17-22)24(19-33(27)15-8-2)16-21-10-11-23(31(36)38-6)18-28(21)37-5/h10-13,17-19,25,29H,7-9,14-16H2,1-6H3,(H,32,35)