8,9-diethoxy-4-(3-ethoxy-4-methoxy-phenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine

Systemtic Name: 8,9-diethoxy-4-(3-ethoxy-4-methoxy-phenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Openeye Name: 8,9-diethoxy-4-(3-ethoxy-4-methoxy-phenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine CAS Name: 8,9-diethoxy-4-(3-ethoxy-4-methoxyphenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine IUPAC Name: 8,9-diethoxy-4-(3-ethoxy-4-methoxyphenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Traditional Name: 8,9-diethoxy-4-(3-ethoxy-4-methoxy-phenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CNC(C3=CC=CN32)C4=CC(=C(C=C4)OC)OCC)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CNC(C3=CC=CN32)C4=CC(=C(C=C4)OC)OCC)OCC

InChI

InChI=1S/C25H30N2O4/c1-5-29-22-13-17(10-11-21(22)28-4)25-19-9-8-12-27(19)20-15-24(31-7-3)23(30-6-2)14-18(20)16-26-25/h8-15,25-26H,5-7,16H2,1-4H3