3-[8-methoxy-7-(2-methoxyphenyl)-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-5-yl]benzamide

Systemtic Name: 3-[8-methoxy-7-(2-methoxyphenyl)-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-5-yl]benzamide Openeye Name: 3-[8-methoxy-7-(2-methoxyphenyl)-2-oxo-1-propyl-3H-1,4-benzodiazepin-5-yl]benzamide CAS Name: 3-[8-methoxy-7-(2-methoxyphenyl)-2-oxo-1-propyl-3H-1,4-benzodiazepin-5-yl]benzamide IUPAC Name: 3-[8-methoxy-7-(2-methoxyphenyl)-2-oxo-1-propyl-3H-1,4-benzodiazepin-5-yl]benzamide Traditional Name: 3-[2-keto-8-methoxy-7-(2-methoxyphenyl)-1-propyl-3H-1,4-benzodiazepin-5-yl]benzamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)CN=C(C2=C1C=C(C(=C2)C3=CC=CC=C3OC)OC)C4=CC(=CC=C4)C(=O)N

Isomeric SMILES

CCCN1C(=O)CN=C(C2=C1C=C(C(=C2)C3=CC=CC=C3OC)OC)C4=CC(=CC=C4)C(=O)N

InChI

InChI=1S/C27H27N3O4/c1-4-12-30-22-15-24(34-3)20(19-10-5-6-11-23(19)33-2)14-21(22)26(29-16-25(30)31)17-8-7-9-18(13-17)27(28)32/h5-11,13-15H,4,12,16H2,1-3H3,(H2,28,32)