[8-chloranyl-3-methyl-5-(3-methylbut-2-enyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ethanoate

Systemtic Name: [8-chloranyl-3-methyl-5-(3-methylbut-2-enyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ethanoate Openeye Name: [8-chloro-3-methyl-5-(3-methylbut-2-enyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl] acetate CAS Name: acetic acid [8-chloro-3-methyl-5-(3-methylbut-2-enyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ester IUPAC Name: [8-chloro-3-methyl-5-(3-methylbut-2-enyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl] acetate Traditional Name: acetic acid [8-chloro-3-methyl-5-(3-methylbut-2-enyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ester Formula: C18H24ClNO2 MolecularWeight: 321.84166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1CN(CCC2=CC(=C(C=C12)OC(=O)C)Cl)C)C

Isomeric SMILES

CC(=CCC1CN(CCC2=CC(=C(C=C12)OC(=O)C)Cl)C)C

InChI

InChI=1S/C18H24ClNO2/c1-12(2)5-6-15-11-20(4)8-7-14-9-17(19)18(10-16(14)15)22-13(3)21/h5,9-10,15H,6-8,11H2,1-4H3