3-[(2,6-dimethylphenyl)methylamino]-4-ethoxy-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(2,6-dimethylphenyl)methylamino]-4-ethoxy-cyclobut-3-ene-1,2-dione Openeye Name: 3-[(2,6-dimethylphenyl)methylamino]-4-ethoxy-cyclobut-3-ene-1,2-dione CAS Name: 3-[(2,6-dimethylphenyl)methylamino]-4-ethoxycyclobut-3-ene-1,2-dione IUPAC Name: 3-[(2,6-dimethylphenyl)methylamino]-4-ethoxycyclobut-3-ene-1,2-dione Traditional Name: 3-[(2,6-dimethylbenzyl)amino]-4-ethoxy-cyclobut-3-ene-1,2-quinone Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)C1=O)NCC2=C(C=CC=C2C)C

Isomeric SMILES

CCOC1=C(C(=O)C1=O)NCC2=C(C=CC=C2C)C

InChI

InChI=1S/C15H17NO3/c1-4-19-15-12(13(17)14(15)18)16-8-11-9(2)6-5-7-10(11)3/h5-7,16H,4,8H2,1-3H3