2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-6-ethoxy-phenol

Systemtic Name: 2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-6-ethoxy-phenol Openeye Name: 2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-6-ethoxy-phenol CAS Name: 2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-6-ethoxyphenol IUPAC Name: 2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-6-ethoxyphenol Traditional Name: 2-(8,9-diethoxy-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)-6-ethoxy-phenol Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C2C3=CC=CN3C4=CC(=C(C=C4CN2)OCC)OCC

Isomeric SMILES

CCOC1=CC=CC(=C1O)C2C3=CC=CN3C4=CC(=C(C=C4CN2)OCC)OCC

InChI

InChI=1S/C24H28N2O4/c1-4-28-20-11-7-9-17(24(20)27)23-18-10-8-12-26(18)19-14-22(30-6-3)21(29-5-2)13-16(19)15-25-23/h7-14,23,25,27H,4-6,15H2,1-3H3