11-[2-[4-[4-(dibutylamino)butyl]phenyl]ethanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 11-[2-[4-[4-(dibutylamino)butyl]phenyl]ethanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one Openeye Name: 11-[2-[4-[4-(dibutylamino)butyl]phenyl]acetyl]-5H-benzo[b][1,4]benzodiazepin-6-one CAS Name: 11-[2-[4-[4-(dibutylamino)butyl]phenyl]-1-oxoethyl]-5H-benzo[b][1,4]benzodiazepin-6-one IUPAC Name: 11-[2-[4-[4-(dibutylamino)butyl]phenyl]acetyl]-5H-benzo[b][1,4]benzodiazepin-6-one Traditional Name: 11-[2-[4-[4-(dibutylamino)butyl]phenyl]acetyl]-5H-benzo[b][1,4]benzodiazepin-6-one Formula: C33H41N3O2 MolecularWeight: 511.69754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCCC1=CC=C(C=C1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=CC=CC=C42

Isomeric SMILES

CCCCN(CCCC)CCCCC1=CC=C(C=C1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=CC=CC=C42

InChI

InChI=1S/C33H41N3O2/c1-3-5-22-35(23-6-4-2)24-12-11-13-26-18-20-27(21-19-26)25-32(37)36-30-16-9-7-14-28(30)33(38)34-29-15-8-10-17-31(29)36/h7-10,14-21H,3-6,11-13,22-25H2,1-2H3,(H,34,38)