(3R,4S)-3-acetyloxy-1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepine-6-carboxylic acid

Systemtic Name: (3R,4S)-3-acetyloxy-1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepine-6-carboxylic acid Openeye Name: (3R,4S)-3-acetoxy-1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-2-oxo-4,5-dihydro-3H-1-benzazepine-6-carboxylic acid CAS Name: (3R,4S)-3-acetyloxy-1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-2-oxo-4,5-dihydro-3H-1-benzazepine-6-carboxylic acid IUPAC Name: (3R,4S)-3-acetyloxy-1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-2-oxo-4,5-dihydro-3H-1-benzazepine-6-carboxylic acid Traditional Name: (3R,4S)-3-acetoxy-1-(2-dimethylaminoethyl)-2-keto-4-(4-methoxyphenyl)-4,5-dihydro-3H-1-benzazepine-6-carboxylic acid Formula: C24H28N2O6 MolecularWeight: 440.48892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(CC2=C(C=CC=C2N(C1=O)CCN(C)C)C(=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)O[C@@H]1[C@@H](CC2=C(C=CC=C2N(C1=O)CCN(C)C)C(=O)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H28N2O6/c1-15(27)32-22-19(16-8-10-17(31-4)11-9-16)14-20-18(24(29)30)6-5-7-21(20)26(23(22)28)13-12-25(2)3/h5-11,19,22H,12-14H2,1-4H3,(H,29,30)/t19-,22+/m0/s1