ethyl 5-(3-cyano-4-phenylazanyl-pyridin-2-yl)oxy-2-(dimethylaminomethyl)-1-(4-methoxyphenyl)indole-3-carboxylate

Systemtic Name: ethyl 5-(3-cyano-4-phenylazanyl-pyridin-2-yl)oxy-2-(dimethylaminomethyl)-1-(4-methoxyphenyl)indole-3-carboxylate Openeye Name: ethyl 5-[(4-anilino-3-cyano-2-pyridyl)oxy]-2-(dimethylaminomethyl)-1-(4-methoxyphenyl)indole-3-carboxylate CAS Name: 5-[(4-anilino-3-cyano-2-pyridinyl)oxy]-2-(dimethylaminomethyl)-1-(4-methoxyphenyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-anilino-3-cyanopyridin-2-yl)oxy-2-(dimethylaminomethyl)-1-(4-methoxyphenyl)indole-3-carboxylate Traditional Name: 5-[(4-anilino-3-cyano-2-pyridyl)oxy]-2-(dimethylaminomethyl)-1-(4-methoxyphenyl)indole-3-carboxylic acid ethyl ester Formula: C33H31N5O4 MolecularWeight: 561.63034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC3=NC=CC(=C3C#N)NC4=CC=CC=C4)C5=CC=C(C=C5)OC)CN(C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC3=NC=CC(=C3C#N)NC4=CC=CC=C4)C5=CC=C(C=C5)OC)CN(C)C

InChI

InChI=1S/C33H31N5O4/c1-5-41-33(39)31-26-19-25(42-32-27(20-34)28(17-18-35-32)36-22-9-7-6-8-10-22)15-16-29(26)38(30(31)21-37(2)3)23-11-13-24(40-4)14-12-23/h6-19H,5,21H2,1-4H3,(H,35,36)