methylcarbamoyl 2-[2-methyl-3-oxidanylidene-4-(2-piperidin-4-ylethyl)-1,5-dihydro-2-benzazepin-4-yl]ethanoate

Systemtic Name: methylcarbamoyl 2-[2-methyl-3-oxidanylidene-4-(2-piperidin-4-ylethyl)-1,5-dihydro-2-benzazepin-4-yl]ethanoate Openeye Name: methylcarbamoyl 2-[2-methyl-3-oxo-4-[2-(4-piperidyl)ethyl]-1,5-dihydro-2-benzazepin-4-yl]acetate CAS Name: 2-[2-methyl-3-oxo-4-[2-(4-piperidinyl)ethyl]-1,5-dihydro-2-benzazepin-4-yl]acetic acid methylcarbamoyl ester IUPAC Name: methylcarbamoyl 2-[2-methyl-3-oxo-4-(2-piperidin-4-ylethyl)-1,5-dihydro-2-benzazepin-4-yl]acetate Traditional Name: 2-[3-keto-2-methyl-4-[2-(4-piperidyl)ethyl]-1,5-dihydro-2-benzazepin-4-yl]acetic acid methylcarbamoyl ester Formula: C22H31N3O4 MolecularWeight: 401.49924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OC(=O)CC1(CC2=CC=CC=C2CN(C1=O)C)CCC3CCNCC3

Isomeric SMILES

CNC(=O)OC(=O)CC1(CC2=CC=CC=C2CN(C1=O)C)CCC3CCNCC3

InChI

InChI=1S/C22H31N3O4/c1-23-21(28)29-19(26)14-22(10-7-16-8-11-24-12-9-16)13-17-5-3-4-6-18(17)15-25(2)20(22)27/h3-6,16,24H,7-15H2,1-2H3,(H,23,28)