ethyl (3S)-1-[[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]carbonyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[3-(p-tolyl)-2,1-benzoxazole-5-carbonyl]piperidine-3-carboxylate CAS Name: (3S)-1-[[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[3-(4-methylphenyl)-2,1-benzoxazole-5-carbonyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[3-(p-tolyl)anthranil-5-carbonyl]nipecotic acid ethyl ester Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(ON=C3C=C2)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)C2=CC3=C(ON=C3C=C2)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H24N2O4/c1-3-28-23(27)18-5-4-12-25(14-18)22(26)17-10-11-20-19(13-17)21(29-24-20)16-8-6-15(2)7-9-16/h6-11,13,18H,3-5,12,14H2,1-2H3/t18-/m0/s1