methyl 3-(1H-indol-3-yl)-2-[[1-(phenylcarbamoyl)piperidin-4-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-(1H-indol-3-yl)-2-[[1-(phenylcarbamoyl)piperidin-4-yl]carbonylamino]propanoate Openeye Name: methyl 3-(1H-indol-3-yl)-2-[[1-(phenylcarbamoyl)piperidine-4-carbonyl]amino]propanoate CAS Name: 2-[[[1-[anilino(oxo)methyl]-4-piperidinyl]-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(1H-indol-3-yl)-2-[[1-(phenylcarbamoyl)piperidine-4-carbonyl]amino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[[1-(phenylcarbamoyl)isonipecotoyl]amino]propionic acid methyl ester Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O4/c1-33-24(31)22(15-18-16-26-21-10-6-5-9-20(18)21)28-23(30)17-11-13-29(14-12-17)25(32)27-19-7-3-2-4-8-19/h2-10,16-17,22,26H,11-15H2,1H3,(H,27,32)(H,28,30)