methyl 3-[6-oxidanylidene-5-[2-oxidanylidene-2-[[4-[(phenylmethyl)carbamoylamino]phenyl]methylamino]ethyl]-11H-benzo[c][1]benzazepin-11-yl]propanoate

Systemtic Name: methyl 3-[6-oxidanylidene-5-[2-oxidanylidene-2-[[4-[(phenylmethyl)carbamoylamino]phenyl]methylamino]ethyl]-11H-benzo[c][1]benzazepin-11-yl]propanoate Openeye Name: methyl 3-[5-[2-[[4-(benzylcarbamoylamino)phenyl]methylamino]-2-oxo-ethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl]propanoate CAS Name: 3-[6-oxo-5-[2-oxo-2-[[4-[[oxo-[(phenylmethyl)amino]methyl]amino]phenyl]methylamino]ethyl]-11H-benzo[c][1]benzazepin-11-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-[2-[[4-(benzylcarbamoylamino)phenyl]methylamino]-2-oxoethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl]propanoate Traditional Name: 3-[5-[2-[[4-(benzylcarbamoylamino)benzyl]amino]-2-keto-ethyl]-6-keto-11H-benzo[c][1]benzazepin-11-yl]propionic acid methyl ester Formula: C35H34N4O5 MolecularWeight: 590.66826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1C2=CC=CC=C2C(=O)N(C3=CC=CC=C13)CC(=O)NCC4=CC=C(C=C4)NC(=O)NCC5=CC=CC=C5

Isomeric SMILES

COC(=O)CCC1C2=CC=CC=C2C(=O)N(C3=CC=CC=C13)CC(=O)NCC4=CC=C(C=C4)NC(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C35H34N4O5/c1-44-33(41)20-19-28-27-11-5-6-13-30(27)34(42)39(31-14-8-7-12-29(28)31)23-32(40)36-21-25-15-17-26(18-16-25)38-35(43)37-22-24-9-3-2-4-10-24/h2-18,28H,19-23H2,1H3,(H,36,40)(H2,37,38,43)