4-[9-chloranyl-7,8-bis(oxidanyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl]-N-ethyl-benzamide

Systemtic Name: 4-[9-chloranyl-7,8-bis(oxidanyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl]-N-ethyl-benzamide Openeye Name: 4-(9-chloro-7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)-N-ethyl-benzamide CAS Name: 4-(9-chloro-7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)-N-ethylbenzamide IUPAC Name: 4-(9-chloro-7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)-N-ethylbenzamide Traditional Name: 4-(9-chloro-7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)-N-ethyl-benzamide Formula: C19H21ClN2O3 MolecularWeight: 360.83464

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)C2CNCCC3=C(C(=C(C=C23)O)O)Cl

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)C2CNCCC3=C(C(=C(C=C23)O)O)Cl

InChI

InChI=1S/C19H21ClN2O3/c1-2-22-19(25)12-5-3-11(4-6-12)15-10-21-8-7-13-14(15)9-16(23)18(24)17(13)20/h3-6,9,15,21,23-24H,2,7-8,10H2,1H3,(H,22,25)