2-[7-[ethyl(methyl)carbamoyl]-3-oxidanylidene-2-piperidin-4-yl-4,5-dihydro-1H-2-benzazepin-4-yl]ethanoic acid

Systemtic Name: 2-[7-[ethyl(methyl)carbamoyl]-3-oxidanylidene-2-piperidin-4-yl-4,5-dihydro-1H-2-benzazepin-4-yl]ethanoic acid Openeye Name: 2-[7-[ethyl(methyl)carbamoyl]-3-oxo-2-(4-piperidyl)-4,5-dihydro-1H-2-benzazepin-4-yl]acetic acid CAS Name: 2-[7-[[ethyl(methyl)amino]-oxomethyl]-3-oxo-2-(4-piperidinyl)-4,5-dihydro-1H-2-benzazepin-4-yl]acetic acid IUPAC Name: 2-[7-[ethyl(methyl)carbamoyl]-3-oxo-2-piperidin-4-yl-4,5-dihydro-1H-2-benzazepin-4-yl]acetic acid Traditional Name: 2-[7-[ethyl(methyl)carbamoyl]-3-keto-2-(4-piperidyl)-4,5-dihydro-1H-2-benzazepin-4-yl]acetic acid Formula: C21H29N3O4 MolecularWeight: 387.47266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)C1=CC2=C(CN(C(=O)C(C2)CC(=O)O)C3CCNCC3)C=C1

Isomeric SMILES

CCN(C)C(=O)C1=CC2=C(CN(C(=O)C(C2)CC(=O)O)C3CCNCC3)C=C1

InChI

InChI=1S/C21H29N3O4/c1-3-23(2)20(27)14-4-5-15-13-24(18-6-8-22-9-7-18)21(28)17(12-19(25)26)11-16(15)10-14/h4-5,10,17-18,22H,3,6-9,11-13H2,1-2H3,(H,25,26)