3-(1,2-dimethylindol-3-yl)imino-8-iodanyl-2-(3-methylphenyl)-2-benzazepin-1-one

Systemtic Name: 3-(1,2-dimethylindol-3-yl)imino-8-iodanyl-2-(3-methylphenyl)-2-benzazepin-1-one Openeye Name: 3-(1,2-dimethylindol-3-yl)imino-8-iodo-2-(m-tolyl)-2-benzazepin-1-one CAS Name: 3-[(1,2-dimethyl-3-indolyl)imino]-8-iodo-2-(3-methylphenyl)-2-benzazepin-1-one IUPAC Name: 3-(1,2-dimethylindol-3-yl)imino-8-iodo-2-(3-methylphenyl)-2-benzazepin-1-one Traditional Name: 3-(1,2-dimethylindol-3-yl)imino-8-iodo-2-(m-tolyl)-2-benzazepin-1-one Formula: C27H22IN3O MolecularWeight: 531.38755

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NC3=C(N(C4=CC=CC=C43)C)C)C=CC5=C(C2=O)C=C(C=C5)I

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NC3=C(N(C4=CC=CC=C43)C)C)C=CC5=C(C2=O)C=C(C=C5)I

InChI

InChI=1S/C27H22IN3O/c1-17-7-6-8-21(15-17)31-25(14-12-19-11-13-20(28)16-23(19)27(31)32)29-26-18(2)30(3)24-10-5-4-9-22(24)26/h4-16H,1-3H3