[4-[(7-chloranyl-2,3,4,5-tetrahydro-1-benzazepin-1-yl)carbonyl]-2-methoxy-phenyl] ethanoate

Systemtic Name: [4-[(7-chloranyl-2,3,4,5-tetrahydro-1-benzazepin-1-yl)carbonyl]-2-methoxy-phenyl] ethanoate Openeye Name: [4-(7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)-2-methoxy-phenyl] acetate CAS Name: acetic acid [4-[(7-chloro-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-oxomethyl]-2-methoxyphenyl] ester IUPAC Name: [4-(7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)-2-methoxyphenyl] acetate Traditional Name: acetic acid [4-(7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)-2-methoxy-phenyl] ester Formula: C20H20ClNO4 MolecularWeight: 373.8301

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C(=O)N2CCCCC3=C2C=CC(=C3)Cl)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C(=O)N2CCCCC3=C2C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H20ClNO4/c1-13(23)26-18-9-6-15(12-19(18)25-2)20(24)22-10-4-3-5-14-11-16(21)7-8-17(14)22/h6-9,11-12H,3-5,10H2,1-2H3