6-[4-(2-methoxyethyl)piperazin-1-yl]-8-nitro-benzo[b][1,4]benzoxazepine

Systemtic Name: 6-[4-(2-methoxyethyl)piperazin-1-yl]-8-nitro-benzo[b][1,4]benzoxazepine Openeye Name: 6-[4-(2-methoxyethyl)piperazin-1-yl]-8-nitro-benzo[b][1,4]benzoxazepine CAS Name: 6-[4-(2-methoxyethyl)-1-piperazinyl]-8-nitrobenzo[b][1,4]benzoxazepine IUPAC Name: 6-[4-(2-methoxyethyl)piperazin-1-yl]-8-nitrobenzo[b][1,4]benzoxazepine Traditional Name: 6-[4-(2-methoxyethyl)piperazino]-8-nitro-benzo[b][1,4]benzoxazepine Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COCCN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4/c1-27-13-12-22-8-10-23(11-9-22)20-16-14-15(24(25)26)6-7-18(16)28-19-5-3-2-4-17(19)21-20/h2-7,14H,8-13H2,1H3