ethyl 6-naphthalen-1-yl-7-oxidanylidene-pyrrolo[2,1-d][1,5]benzoxazepine-3-carboxylate

Systemtic Name: ethyl 6-naphthalen-1-yl-7-oxidanylidene-pyrrolo[2,1-d][1,5]benzoxazepine-3-carboxylate Openeye Name: ethyl 6-(1-naphthyl)-7-oxo-pyrrolo[2,1-d][1,5]benzoxazepine-3-carboxylate CAS Name: 6-(1-naphthalenyl)-7-oxo-3-pyrrolo[2,1-d][1,5]benzoxazepinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-naphthalen-1-yl-7-oxopyrrolo[2,1-d][1,5]benzoxazepine-3-carboxylate Traditional Name: 7-keto-6-(1-naphthyl)pyrrolo[2,1-d][1,5]benzoxazepine-3-carboxylic acid ethyl ester Formula: C25H19NO4 MolecularWeight: 397.42266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N3C=CC=C3C(=O)C(O2)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N3C=CC=C3C(=O)C(O2)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H19NO4/c1-2-29-25(28)17-12-13-20-22(15-17)30-24(23(27)21-11-6-14-26(20)21)19-10-5-8-16-7-3-4-9-18(16)19/h3-15,24H,2H2,1H3