2-chloranyl-N-[4-[[7-chloranyl-5-(2-imidazol-1-ylethoxy)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]-3-methoxy-phenyl]benzamide

Systemtic Name: 2-chloranyl-N-[4-[[7-chloranyl-5-(2-imidazol-1-ylethoxy)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]-3-methoxy-phenyl]benzamide Openeye Name: 2-chloro-N-[4-[7-chloro-5-(2-imidazol-1-ylethoxy)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methoxy-phenyl]benzamide CAS Name: 2-chloro-N-[4-[[7-chloro-5-[2-(1-imidazolyl)ethoxy]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-oxomethyl]-3-methoxyphenyl]benzamide IUPAC Name: 2-chloro-N-[4-[7-chloro-5-(2-imidazol-1-ylethoxy)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methoxyphenyl]benzamide Traditional Name: 2-chloro-N-[4-[7-chloro-5-(2-imidazol-1-ylethoxy)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methoxy-phenyl]benzamide Formula: C30H28Cl2N4O4 MolecularWeight: 579.47372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2Cl)C(=O)N3CCCC(C4=C3C=CC(=C4)Cl)OCCN5C=CN=C5

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2Cl)C(=O)N3CCCC(C4=C3C=CC(=C4)Cl)OCCN5C=CN=C5

InChI

InChI=1S/C30H28Cl2N4O4/c1-39-28-18-21(34-29(37)22-5-2-3-6-25(22)32)9-10-23(28)30(38)36-13-4-7-27(24-17-20(31)8-11-26(24)36)40-16-15-35-14-12-33-19-35/h2-3,5-6,8-12,14,17-19,27H,4,7,13,15-16H2,1H3,(H,34,37)