8-chloranyl-7-methoxy-3-methyl-5-(5-nitro-2,3-dihydro-1-benzofuran-7-yl)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride

Systemtic Name: 8-chloranyl-7-methoxy-3-methyl-5-(5-nitro-2,3-dihydro-1-benzofuran-7-yl)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride Openeye Name: 8-chloro-7-methoxy-3-methyl-5-(5-nitro-2,3-dihydrobenzofuran-7-yl)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride CAS Name: 8-chloro-7-methoxy-3-methyl-5-(5-nitro-2,3-dihydrobenzofuran-7-yl)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride IUPAC Name: 8-chloro-7-methoxy-3-methyl-5-(5-nitro-2,3-dihydro-1-benzofuran-7-yl)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride Traditional Name: 8-chloro-7-methoxy-3-methyl-5-(5-nitrocoumaran-7-yl)-1,2,4,5-tetrahydro-3-benzazepine hydrochloride Formula: C20H22Cl2N2O4 MolecularWeight: 425.30568

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC(=C(C=C2C(C1)C3=C4C(=CC(=C3)[N+](=O)[O-])CCO4)OC)Cl.Cl

Isomeric SMILES

CN1CCC2=CC(=C(C=C2C(C1)C3=C4C(=CC(=C3)[N+](=O)[O-])CCO4)OC)Cl.Cl

InChI

InChI=1S/C20H21ClN2O4.ClH/c1-22-5-3-12-8-18(21)19(26-2)10-15(12)17(11-22)16-9-14(23(24)25)7-13-4-6-27-20(13)16;/h7-10,17H,3-6,11H2,1-2H3;1H