N-[3-chloranyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-2-ethoxy-naphthalene-1-carboxamide

Systemtic Name: N-[3-chloranyl-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-2-ethoxy-naphthalene-1-carboxamide Openeye Name: N-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-2-ethoxy-naphthalene-1-carboxamide CAS Name: N-[3-chloro-6-(4-methyl-1-piperazinyl)-11-benzo[b][1,4]benzodiazepinyl]-2-ethoxy-1-naphthalenecarboxamide IUPAC Name: N-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-2-ethoxynaphthalene-1-carboxamide Traditional Name: N-[3-chloro-6-(4-methylpiperazino)benzo[b][1,4]benzodiazepin-11-yl]-2-ethoxy-1-naphthamide Formula: C31H30ClN5O2 MolecularWeight: 540.0552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NN3C4=C(C=C(C=C4)Cl)N=C(C5=CC=CC=C53)N6CCN(CC6)C

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NN3C4=C(C=C(C=C4)Cl)N=C(C5=CC=CC=C53)N6CCN(CC6)C

InChI

InChI=1S/C31H30ClN5O2/c1-3-39-28-15-12-21-8-4-5-9-23(21)29(28)31(38)34-37-26-11-7-6-10-24(26)30(36-18-16-35(2)17-19-36)33-25-20-22(32)13-14-27(25)37/h4-15,20H,3,16-19H2,1-2H3,(H,34,38)