3-methoxy-4-[(phenylmethyl)amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-methoxy-4-[(phenylmethyl)amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(benzylamino)-4-methoxy-cyclobut-3-ene-1,2-dione CAS Name: 3-methoxy-4-[(phenylmethyl)amino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(benzylamino)-4-methoxycyclobut-3-ene-1,2-dione Traditional Name: 3-(benzylamino)-4-methoxy-cyclobut-3-ene-1,2-quinone Formula: C12H11NO3 MolecularWeight: 217.22064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C1=O)NCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=O)C1=O)NCC2=CC=CC=C2

InChI

InChI=1S/C12H11NO3/c1-16-12-9(10(14)11(12)15)13-7-8-5-3-2-4-6-8/h2-6,13H,7H2,1H3