[6-(aziridin-1-yl)-5,8-bis(oxidanylidene)naphthalen-1-yl] 4-methoxybenzoate

Systemtic Name: [6-(aziridin-1-yl)-5,8-bis(oxidanylidene)naphthalen-1-yl] 4-methoxybenzoate Openeye Name: [6-(aziridin-1-yl)-5,8-dioxo-1-naphthyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [6-(1-aziridinyl)-5,8-dioxo-1-naphthalenyl] ester IUPAC Name: [6-(aziridin-1-yl)-5,8-dioxonaphthalen-1-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid (6-ethylenimino-5,8-diketo-1-naphthyl) ester Formula: C20H15NO5 MolecularWeight: 349.3368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2=CC=CC3=C2C(=O)C=C(C3=O)N4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC2=CC=CC3=C2C(=O)C=C(C3=O)N4CC4

InChI

InChI=1S/C20H15NO5/c1-25-13-7-5-12(6-8-13)20(24)26-17-4-2-3-14-18(17)16(22)11-15(19(14)23)21-9-10-21/h2-8,11H,9-10H2,1H3