3-phenylpropyl 5-[[4-(4-methylpiperidin-1-yl)carbonylphenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[[4-(4-methylpiperidin-1-yl)carbonylphenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[4-(4-methylpiperidine-1-carbonyl)anilino]-5-oxo-pentanoate CAS Name: 5-[4-[(4-methyl-1-piperidinyl)-oxomethyl]anilino]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[4-(4-methylpiperidine-1-carbonyl)anilino]-5-oxopentanoate Traditional Name: 5-keto-5-[4-(4-methylpiperidine-1-carbonyl)anilino]valeric acid 3-phenylpropyl ester Formula: C27H34N2O4 MolecularWeight: 450.56986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C27H34N2O4/c1-21-16-18-29(19-17-21)27(32)23-12-14-24(15-13-23)28-25(30)10-5-11-26(31)33-20-6-9-22-7-3-2-4-8-22/h2-4,7-8,12-15,21H,5-6,9-11,16-20H2,1H3,(H,28,30)