ethyl 4-(5-chloranyl-2-phenyl-1H-indol-3-yl)-2,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 4-(5-chloranyl-2-phenyl-1H-indol-3-yl)-2,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-benzyl-4-(5-chloro-2-phenyl-1H-indol-3-yl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 4-(5-chloro-2-phenyl-1H-indol-3-yl)-2,5-dimethyl-1-(phenylmethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-4-(5-chloro-2-phenyl-1H-indol-3-yl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-benzyl-4-(5-chloro-2-phenyl-1H-indol-3-yl)-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C30H27ClN2O2 MolecularWeight: 483.00058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C2=C(NC3=C2C=C(C=C3)Cl)C4=CC=CC=C4)C)CC5=CC=CC=C5)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C2=C(NC3=C2C=C(C=C3)Cl)C4=CC=CC=C4)C)CC5=CC=CC=C5)C

InChI

InChI=1S/C30H27ClN2O2/c1-4-35-30(34)27-20(3)33(18-21-11-7-5-8-12-21)19(2)26(27)28-24-17-23(31)15-16-25(24)32-29(28)22-13-9-6-10-14-22/h5-17,32H,4,18H2,1-3H3