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

Systemtic Name: (phenylmethyl) 4-[[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]methylamino]benzoate Openeye Name: benzyl 4-[(3,6-dioxocyclohexa-1,4-dien-1-yl)methylamino]benzoate CAS Name: 4-[(3,6-dioxo-1-cyclohexa-1,4-dienyl)methylamino]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(3,6-dioxocyclohexa-1,4-dien-1-yl)methylamino]benzoate Traditional Name: 4-[(3,6-diketocyclohexa-1,4-dien-1-yl)methylamino]benzoic acid benzyl ester Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)NCC3=CC(=O)C=CC3=O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)NCC3=CC(=O)C=CC3=O

InChI

InChI=1S/C21H17NO4/c23-19-10-11-20(24)17(12-19)13-22-18-8-6-16(7-9-18)21(25)26-14-15-4-2-1-3-5-15/h1-12,22H,13-14H2