tert-butyl 13-cyclohexyl-3-methoxy-6-(4-methoxycarbonyl-2,5-dimethyl-pyrazol-3-yl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate

Systemtic Name: tert-butyl 13-cyclohexyl-3-methoxy-6-(4-methoxycarbonyl-2,5-dimethyl-pyrazol-3-yl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate Openeye Name: tert-butyl 13-cyclohexyl-3-methoxy-6-(4-methoxycarbonyl-2,5-dimethyl-pyrazol-3-yl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate CAS Name: 13-cyclohexyl-3-methoxy-6-(4-methoxycarbonyl-2,5-dimethyl-3-pyrazolyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 13-cyclohexyl-3-methoxy-6-(4-methoxycarbonyl-2,5-dimethylpyrazol-3-yl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate Traditional Name: 6-(4-carbomethoxy-2,5-dimethyl-pyrazol-3-yl)-13-cyclohexyl-3-methoxy-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid tert-butyl ester Formula: C36H41N3O5 MolecularWeight: 595.72784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OC)C2=CC3=C(C=CC(=C3)OC)C4=C(C5=C(N4C2)C=C(C=C5)C(=O)OC(C)(C)C)C6CCCCC6)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)OC)C2=CC3=C(C=CC(=C3)OC)C4=C(C5=C(N4C2)C=C(C=C5)C(=O)OC(C)(C)C)C6CCCCC6)C

InChI

InChI=1S/C36H41N3O5/c1-21-30(35(41)43-7)32(38(5)37-21)25-17-24-18-26(42-6)14-16-27(24)33-31(22-11-9-8-10-12-22)28-15-13-23(19-29(28)39(33)20-25)34(40)44-36(2,3)4/h13-19,22H,8-12,20H2,1-7H3