4-(1H-indol-3-yl)-2-[[[1-(3-piperidin-4-ylpropanoyl)piperidin-3-yl]carbonylamino]methyl]butanoic acid

Systemtic Name: 4-(1H-indol-3-yl)-2-[[[1-(3-piperidin-4-ylpropanoyl)piperidin-3-yl]carbonylamino]methyl]butanoic acid Openeye Name: 4-(1H-indol-3-yl)-2-[[[1-[3-(4-piperidyl)propanoyl]piperidine-3-carbonyl]amino]methyl]butanoic acid CAS Name: 4-(1H-indol-3-yl)-2-[[[oxo-[1-[1-oxo-3-(4-piperidinyl)propyl]-3-piperidinyl]methyl]amino]methyl]butanoic acid IUPAC Name: 4-(1H-indol-3-yl)-2-[[[1-(3-piperidin-4-ylpropanoyl)piperidine-3-carbonyl]amino]methyl]butanoic acid Traditional Name: 4-(1H-indol-3-yl)-2-[[[1-[3-(4-piperidyl)propanoyl]nipecotoyl]amino]methyl]butyric acid Formula: C27H38N4O4 MolecularWeight: 482.61502

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCC2CCNCC2)C(=O)NCC(CCC3=CNC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)CCC2CCNCC2)C(=O)NCC(CCC3=CNC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C27H38N4O4/c32-25(10-7-19-11-13-28-14-12-19)31-15-3-4-22(18-31)26(33)30-17-21(27(34)35)9-8-20-16-29-24-6-2-1-5-23(20)24/h1-2,5-6,16,19,21-22,28-29H,3-4,7-15,17-18H2,(H,30,33)(H,34,35)