N-[4-[[7-chloranyl-5-(1-morpholin-4-ylethyl)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]-3-methyl-phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[[7-chloranyl-5-(1-morpholin-4-ylethyl)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]-3-methyl-phenyl]-2-methyl-benzamide Openeye Name: N-[4-[7-chloro-5-(1-morpholinoethyl)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methyl-phenyl]-2-methyl-benzamide CAS Name: N-[4-[[7-chloro-5-[1-(4-morpholinyl)ethyl]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-oxomethyl]-3-methylphenyl]-2-methylbenzamide IUPAC Name: N-[4-[7-chloro-5-(1-morpholin-4-ylethyl)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methylphenyl]-2-methylbenzamide Traditional Name: N-[4-[7-chloro-5-(1-morpholinoethyl)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methyl-phenyl]-2-methyl-benzamide Formula: C32H36ClN3O3 MolecularWeight: 546.09954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)C(=O)N3CCCC(C4=C3C=CC(=C4)Cl)C(C)N5CCOCC5)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)C(=O)N3CCCC(C4=C3C=CC(=C4)Cl)C(C)N5CCOCC5)C

InChI

InChI=1S/C32H36ClN3O3/c1-21-7-4-5-8-26(21)31(37)34-25-11-12-27(22(2)19-25)32(38)36-14-6-9-28(23(3)35-15-17-39-18-16-35)29-20-24(33)10-13-30(29)36/h4-5,7-8,10-13,19-20,23,28H,6,9,14-18H2,1-3H3,(H,34,37)