9-chloranyl-7,8-diethyl-5-(4-hydroxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide

Systemtic Name: 9-chloranyl-7,8-diethyl-5-(4-hydroxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide Openeye Name: 9-chloro-7,8-diethyl-5-(4-hydroxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide CAS Name: 9-chloro-7,8-diethyl-5-(4-hydroxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide IUPAC Name: 9-chloro-7,8-diethyl-5-(4-hydroxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide Traditional Name: 9-chloro-7,8-diethyl-5-(4-hydroxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide Formula: C21H25ClN2O2 MolecularWeight: 372.8884

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2CCN(CC(C2=C1)C3=CC=C(C=C3)O)C(=O)N)Cl)CC

Isomeric SMILES

CCC1=C(C(=C2CCN(CC(C2=C1)C3=CC=C(C=C3)O)C(=O)N)Cl)CC

InChI

InChI=1S/C21H25ClN2O2/c1-3-13-11-18-17(20(22)16(13)4-2)9-10-24(21(23)26)12-19(18)14-5-7-15(25)8-6-14/h5-8,11,19,25H,3-4,9-10,12H2,1-2H3,(H2,23,26)