4-azanyl-1-(8-chloranyl-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)butan-1-one

Systemtic Name: 4-azanyl-1-(8-chloranyl-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)butan-1-one Openeye Name: 4-amino-1-(8-chloro-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)butan-1-one CAS Name: 4-amino-1-(8-chloro-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1-butanone IUPAC Name: 4-amino-1-(8-chloro-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)butan-1-one Traditional Name: 4-amino-1-(8-chloro-7-methoxy-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)butan-1-one Formula: C21H25ClN2O2 MolecularWeight: 372.8884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CCN(CC(C2=C1)C3=CC=CC=C3)C(=O)CCCN)Cl

Isomeric SMILES

COC1=C(C=C2CCN(CC(C2=C1)C3=CC=CC=C3)C(=O)CCCN)Cl

InChI

InChI=1S/C21H25ClN2O2/c1-26-20-13-17-16(12-19(20)22)9-11-24(21(25)8-5-10-23)14-18(17)15-6-3-2-4-7-15/h2-4,6-7,12-13,18H,5,8-11,14,23H2,1H3