[8-acetyloxy-9-chloranyl-5-phenyl-3-[(E)-prop-1-enyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ethanoate

Systemtic Name: [8-acetyloxy-9-chloranyl-5-phenyl-3-[(E)-prop-1-enyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ethanoate Openeye Name: [8-acetoxy-9-chloro-5-phenyl-3-[(E)-prop-1-enyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl] acetate CAS Name: acetic acid [8-acetyloxy-9-chloro-5-phenyl-3-[(E)-prop-1-enyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ester IUPAC Name: [8-acetyloxy-9-chloro-5-phenyl-3-[(E)-prop-1-enyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl] acetate Traditional Name: acetic acid [8-acetoxy-9-chloro-5-phenyl-3-[(E)-prop-1-enyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ester Formula: C23H24ClNO4 MolecularWeight: 413.89396

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Descriptors Computed from Structure

Canonical SMILES:

CC=CN1CCC2=C(C(=C(C=C2C(C1)C3=CC=CC=C3)OC(=O)C)OC(=O)C)Cl

Isomeric SMILES

C/C=C/N1CCC2=C(C(=C(C=C2C(C1)C3=CC=CC=C3)OC(=O)C)OC(=O)C)Cl

InChI

InChI=1S/C23H24ClNO4/c1-4-11-25-12-10-18-19(20(14-25)17-8-6-5-7-9-17)13-21(28-15(2)26)23(22(18)24)29-16(3)27/h4-9,11,13,20H,10,12,14H2,1-3H3/b11-4+