dimethyl (E)-2-(1a,9b-dihydrophenanthro[9,10-b]azirin-1-yl)but-2-enedioate

Systemtic Name: dimethyl (E)-2-(1a,9b-dihydrophenanthro[9,10-b]azirin-1-yl)but-2-enedioate Openeye Name: dimethyl (E)-2-(1a,9b-dihydrophenanthro[9,10-b]azirin-1-yl)but-2-enedioate CAS Name: (E)-2-(1a,9b-dihydrophenanthro[9,10-b]azirin-1-yl)-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-(1a,9b-dihydrophenanthro[9,10-b]azirin-1-yl)but-2-enedioate Traditional Name: (E)-2-(1a,9b-dihydrophenanthr[9,10-b]azirin-1-yl)but-2-enedioic acid dimethyl ester Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)OC)N1C2C1C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

COC(=O)/C=C(\C(=O)OC)/N1C2C1C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C20H17NO4/c1-24-17(22)11-16(20(23)25-2)21-18-14-9-5-3-7-12(14)13-8-4-6-10-15(13)19(18)21/h3-11,18-19H,1-2H3/b16-11+