ethyl 5-methoxy-1,2-dimethyl-4-[2-[4-(phenylmethyl)piperidin-1-yl]ethanoylamino]indole-3-carboxylate

Systemtic Name: ethyl 5-methoxy-1,2-dimethyl-4-[2-[4-(phenylmethyl)piperidin-1-yl]ethanoylamino]indole-3-carboxylate Openeye Name: ethyl 4-[[2-(4-benzyl-1-piperidyl)acetyl]amino]-5-methoxy-1,2-dimethyl-indole-3-carboxylate CAS Name: 5-methoxy-1,2-dimethyl-4-[[1-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]amino]-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-benzylpiperidin-1-yl)acetyl]amino]-5-methoxy-1,2-dimethylindole-3-carboxylate Traditional Name: 4-[[2-(4-benzylpiperidino)acetyl]amino]-5-methoxy-1,2-dimethyl-indole-3-carboxylic acid ethyl ester Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)OC)NC(=O)CN3CCC(CC3)CC4=CC=CC=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)OC)NC(=O)CN3CCC(CC3)CC4=CC=CC=C4)C)C

InChI

InChI=1S/C28H35N3O4/c1-5-35-28(33)25-19(2)30(3)22-11-12-23(34-4)27(26(22)25)29-24(32)18-31-15-13-21(14-16-31)17-20-9-7-6-8-10-20/h6-12,21H,5,13-18H2,1-4H3,(H,29,32)