methyl 4-methyl-2-[[1-(phenylcarbamoyl)piperidin-3-yl]carbonylamino]pentanoate

Systemtic Name: methyl 4-methyl-2-[[1-(phenylcarbamoyl)piperidin-3-yl]carbonylamino]pentanoate Openeye Name: methyl 4-methyl-2-[[1-(phenylcarbamoyl)piperidine-3-carbonyl]amino]pentanoate CAS Name: 2-[[[1-[anilino(oxo)methyl]-3-piperidinyl]-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[1-(phenylcarbamoyl)piperidine-3-carbonyl]amino]pentanoate Traditional Name: 4-methyl-2-[[1-(phenylcarbamoyl)nipecotoyl]amino]valeric acid methyl ester Formula: C20H29N3O4 MolecularWeight: 375.46196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1CCCN(C1)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)C1CCCN(C1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C20H29N3O4/c1-14(2)12-17(19(25)27-3)22-18(24)15-8-7-11-23(13-15)20(26)21-16-9-5-4-6-10-16/h4-6,9-10,14-15,17H,7-8,11-13H2,1-3H3,(H,21,26)(H,22,24)