N-[6,12-bis(oxidanylidene)-5,6a,7,8,9,10-hexahydropyrido[2,1-c][1,4]benzodiazepin-8-yl]-4-methoxy-benzamide

Systemtic Name: N-[6,12-bis(oxidanylidene)-5,6a,7,8,9,10-hexahydropyrido[2,1-c][1,4]benzodiazepin-8-yl]-4-methoxy-benzamide Openeye Name: N-(6,12-dioxo-5,6a,7,8,9,10-hexahydropyrido[2,1-c][1,4]benzodiazepin-8-yl)-4-methoxy-benzamide CAS Name: N-(6,12-dioxo-5,6a,7,8,9,10-hexahydropyrido[2,1-c][1,4]benzodiazepin-8-yl)-4-methoxybenzamide IUPAC Name: N-(6,12-dioxo-5,6a,7,8,9,10-hexahydropyrido[2,1-c][1,4]benzodiazepin-8-yl)-4-methoxybenzamide Traditional Name: N-(6,12-diketo-5,6a,7,8,9,10-hexahydropyrido[2,1-c][1,4]benzodiazepin-8-yl)-4-methoxy-benzamide Formula: C21H21N3O4 MolecularWeight: 379.40914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2CCN3C(C2)C(=O)NC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2CCN3C(C2)C(=O)NC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H21N3O4/c1-28-15-8-6-13(7-9-15)19(25)22-14-10-11-24-18(12-14)20(26)23-17-5-3-2-4-16(17)21(24)27/h2-9,14,18H,10-12H2,1H3,(H,22,25)(H,23,26)