N-[6-(4-chloranyl-2-methyl-phenoxy)pyridin-3-yl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide

Systemtic Name: N-[6-(4-chloranyl-2-methyl-phenoxy)pyridin-3-yl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide Openeye Name: N-[6-(4-chloro-2-methyl-phenoxy)-3-pyridyl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide CAS Name: N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide IUPAC Name: N-[6-(4-chloro-2-methylphenoxy)pyridin-3-yl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide Traditional Name: N-[6-(4-chloro-2-methyl-phenoxy)-3-pyridyl]-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide Formula: C23H22ClN3O2 MolecularWeight: 407.89268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC2=NC=C(C=C2)NC(=O)N3CCC4=CC=CC=C4CC3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC2=NC=C(C=C2)NC(=O)N3CCC4=CC=CC=C4CC3

InChI

InChI=1S/C23H22ClN3O2/c1-16-14-19(24)6-8-21(16)29-22-9-7-20(15-25-22)26-23(28)27-12-10-17-4-2-3-5-18(17)11-13-27/h2-9,14-15H,10-13H2,1H3,(H,26,28)