propan-2-yl 4-[[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]methylamino]-2-chloranyl-benzoate

Systemtic Name: propan-2-yl 4-[[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]methylamino]-2-chloranyl-benzoate Openeye Name: isopropyl 2-chloro-4-[(3,6-dioxocyclohexa-1,4-dien-1-yl)methylamino]benzoate CAS Name: 2-chloro-4-[(3,6-dioxo-1-cyclohexa-1,4-dienyl)methylamino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-chloro-4-[(3,6-dioxocyclohexa-1,4-dien-1-yl)methylamino]benzoate Traditional Name: 2-chloro-4-[(3,6-diketocyclohexa-1,4-dien-1-yl)methylamino]benzoic acid isopropyl ester Formula: C17H16ClNO4 MolecularWeight: 333.76624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C=C(C=C1)NCC2=CC(=O)C=CC2=O)Cl

Isomeric SMILES

CC(C)OC(=O)C1=C(C=C(C=C1)NCC2=CC(=O)C=CC2=O)Cl

InChI

InChI=1S/C17H16ClNO4/c1-10(2)23-17(22)14-5-3-12(8-15(14)18)19-9-11-7-13(20)4-6-16(11)21/h3-8,10,19H,9H2,1-2H3