10-methoxy-6-(4-methylsulfonyl-1,4-diazepan-1-yl)benzo[b][1,4]benzoxazepine

Systemtic Name: 10-methoxy-6-(4-methylsulfonyl-1,4-diazepan-1-yl)benzo[b][1,4]benzoxazepine Openeye Name: 10-methoxy-6-(4-methylsulfonyl-1,4-diazepan-1-yl)benzo[b][1,4]benzoxazepine CAS Name: 10-methoxy-6-(4-methylsulfonyl-1,4-diazepan-1-yl)benzo[b][1,4]benzoxazepine IUPAC Name: 10-methoxy-6-(4-methylsulfonyl-1,4-diazepan-1-yl)benzo[b][1,4]benzoxazepine Traditional Name: 6-(4-mesyl-1,4-diazepan-1-yl)-10-methoxy-benzo[b][1,4]benzoxazepine Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC3=CC=CC=C3N=C2N4CCCN(CC4)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC2=C1OC3=CC=CC=C3N=C2N4CCCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C20H23N3O4S/c1-26-18-10-5-7-15-19(18)27-17-9-4-3-8-16(17)21-20(15)22-11-6-12-23(14-13-22)28(2,24)25/h3-5,7-10H,6,11-14H2,1-2H3