(2S)-2-acetamido-N-[1-(3-methylphenyl)carbonylpiperidin-4-yl]-3-(4-propan-2-ylphenyl)propanamide

Systemtic Name: (2S)-2-acetamido-N-[1-(3-methylphenyl)carbonylpiperidin-4-yl]-3-(4-propan-2-ylphenyl)propanamide Openeye Name: (2S)-2-acetamido-3-(4-isopropylphenyl)-N-[1-(3-methylbenzoyl)-4-piperidyl]propanamide CAS Name: (2S)-2-acetamido-N-[1-[(3-methylphenyl)-oxomethyl]-4-piperidinyl]-3-(4-propan-2-ylphenyl)propanamide IUPAC Name: (2S)-2-acetamido-N-[1-(3-methylbenzoyl)piperidin-4-yl]-3-(4-propan-2-ylphenyl)propanamide Traditional Name: (2S)-2-acetamido-N-(1-m-toluoyl-4-piperidyl)-3-p-cumenyl-propionamide Formula: C27H35N3O3 MolecularWeight: 449.5851

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCC(CC2)NC(=O)C(CC3=CC=C(C=C3)C(C)C)NC(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCC(CC2)NC(=O)[C@H](CC3=CC=C(C=C3)C(C)C)NC(=O)C

InChI

InChI=1S/C27H35N3O3/c1-18(2)22-10-8-21(9-11-22)17-25(28-20(4)31)26(32)29-24-12-14-30(15-13-24)27(33)23-7-5-6-19(3)16-23/h5-11,16,18,24-25H,12-15,17H2,1-4H3,(H,28,31)(H,29,32)/t25-/m0/s1