1-methyl-3-[(3S)-3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]carbonyl-quinolin-4-one

Systemtic Name: 1-methyl-3-[(3S)-3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]carbonyl-quinolin-4-one Openeye Name: 3-[(3S)-3-(4-isopropylanilino)piperidine-1-carbonyl]-1-methyl-quinolin-4-one CAS Name: 1-methyl-3-[oxo-[(3S)-3-(4-propan-2-ylanilino)-1-piperidinyl]methyl]-4-quinolinone IUPAC Name: 1-methyl-3-[(3S)-3-(4-propan-2-ylanilino)piperidine-1-carbonyl]quinolin-4-one Traditional Name: 3-[(3S)-3-cumidinopiperidine-1-carbonyl]-1-methyl-4-quinolone Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2CCCN(C2)C(=O)C3=CN(C4=CC=CC=C4C3=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N[C@H]2CCCN(C2)C(=O)C3=CN(C4=CC=CC=C4C3=O)C

InChI

InChI=1S/C25H29N3O2/c1-17(2)18-10-12-19(13-11-18)26-20-7-6-14-28(15-20)25(30)22-16-27(3)23-9-5-4-8-21(23)24(22)29/h4-5,8-13,16-17,20,26H,6-7,14-15H2,1-3H3/t20-/m0/s1