(7-chloranyl-3-methyl-1-phenyl-2,3,4,5-tetrahydro-1-benzazepin-8-yl) N-(3-oxidanylpropyl)carbamate

Systemtic Name: (7-chloranyl-3-methyl-1-phenyl-2,3,4,5-tetrahydro-1-benzazepin-8-yl) N-(3-oxidanylpropyl)carbamate Openeye Name: (7-chloro-3-methyl-1-phenyl-2,3,4,5-tetrahydro-1-benzazepin-8-yl) N-(3-hydroxypropyl)carbamate CAS Name: N-(3-hydroxypropyl)carbamic acid (7-chloro-3-methyl-1-phenyl-2,3,4,5-tetrahydro-1-benzazepin-8-yl) ester IUPAC Name: (7-chloro-3-methyl-1-phenyl-2,3,4,5-tetrahydro-1-benzazepin-8-yl) N-(3-hydroxypropyl)carbamate Traditional Name: N-(3-hydroxypropyl)carbamic acid (7-chloro-3-methyl-1-phenyl-2,3,4,5-tetrahydro-1-benzazepin-8-yl) ester Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=CC(=C(C=C2N(C1)C3=CC=CC=C3)OC(=O)NCCCO)Cl

Isomeric SMILES

CC1CCC2=CC(=C(C=C2N(C1)C3=CC=CC=C3)OC(=O)NCCCO)Cl

InChI

InChI=1S/C21H25ClN2O3/c1-15-8-9-16-12-18(22)20(27-21(26)23-10-5-11-25)13-19(16)24(14-15)17-6-3-2-4-7-17/h2-4,6-7,12-13,15,25H,5,8-11,14H2,1H3,(H,23,26)