4-chloranyl-3-methyl-6-(pyrrol-1-ylmethyl)-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 4-chloranyl-3-methyl-6-(pyrrol-1-ylmethyl)-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 4-chloro-3-methyl-6-(pyrrol-1-ylmethyl)-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 4-chloro-3-methyl-6-(1-pyrrolylmethyl)-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 4-chloro-3-methyl-6-(pyrrol-1-ylmethyl)-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 4-chloro-3-methyl-6-(pyrrol-1-ylmethyl)-1,2,4,5-tetrahydro-3-benzazepine Formula: C16H19ClN2 MolecularWeight: 274.78846

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(CC1Cl)C(=CC=C2)CN3C=CC=C3

Isomeric SMILES

CN1CCC2=C(CC1Cl)C(=CC=C2)CN3C=CC=C3

InChI

InChI=1S/C16H19ClN2/c1-18-10-7-13-5-4-6-14(15(13)11-16(18)17)12-19-8-2-3-9-19/h2-6,8-9,16H,7,10-12H2,1H3