ethyl 1-[2-[(3-methylphenyl)amino]-3,4-bis(oxidanylidene)cyclobuten-1-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[(3-methylphenyl)amino]-3,4-bis(oxidanylidene)cyclobuten-1-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(3-methylanilino)-3,4-dioxo-cyclobuten-1-yl]piperidine-3-carboxylate CAS Name: 1-[2-(3-methylanilino)-3,4-dioxo-1-cyclobutenyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-methylanilino)-3,4-dioxocyclobuten-1-yl]piperidine-3-carboxylate Traditional Name: 1-[3,4-diketo-2-(m-toluidino)cyclobuten-1-yl]nipecotic acid ethyl ester Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=C(C(=O)C2=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=C(C(=O)C2=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C19H22N2O4/c1-3-25-19(24)13-7-5-9-21(11-13)16-15(17(22)18(16)23)20-14-8-4-6-12(2)10-14/h4,6,8,10,13,20H,3,5,7,9,11H2,1-2H3