13-cyclohexyl-6-[3-(dimethylcarbamoyl)pyridin-2-yl]-3-methoxy-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid

Systemtic Name: 13-cyclohexyl-6-[3-(dimethylcarbamoyl)pyridin-2-yl]-3-methoxy-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid Openeye Name: 13-cyclohexyl-6-[3-(dimethylcarbamoyl)-2-pyridyl]-3-methoxy-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid CAS Name: 13-cyclohexyl-6-[3-[dimethylamino(oxo)methyl]-2-pyridinyl]-3-methoxy-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid IUPAC Name: 13-cyclohexyl-6-[3-(dimethylcarbamoyl)pyridin-2-yl]-3-methoxy-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid Traditional Name: 13-cyclohexyl-6-[3-(dimethylcarbamoyl)-2-pyridyl]-3-methoxy-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid Formula: C33H33N3O4 MolecularWeight: 535.63282

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=C(N=CC=C1)C2=CC3=C(C=CC(=C3)OC)C4=C(C5=C(N4C2)C=C(C=C5)C(=O)O)C6CCCCC6

Isomeric SMILES

CN(C)C(=O)C1=C(N=CC=C1)C2=CC3=C(C=CC(=C3)OC)C4=C(C5=C(N4C2)C=C(C=C5)C(=O)O)C6CCCCC6

InChI

InChI=1S/C33H33N3O4/c1-35(2)32(37)27-10-7-15-34-30(27)23-16-22-17-24(40-3)12-14-25(22)31-29(20-8-5-4-6-9-20)26-13-11-21(33(38)39)18-28(26)36(31)19-23/h7,10-18,20H,4-6,8-9,19H2,1-3H3,(H,38,39)