ethyl 3-[3-(4-ethoxycarbonylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[3-(4-ethoxycarbonylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate Openeye Name: ethyl 3-[3-(4-ethoxycarbonylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate CAS Name: 3-[[3-(4-ethoxycarbonyl-1-piperazinyl)-1-oxopropyl]amino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-(4-ethoxycarbonylpiperazin-1-yl)propanoylamino]-5-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[3-(4-carbethoxypiperazino)propanoylamino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester Formula: C22H30N4O6 MolecularWeight: 446.4968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CCN3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CCN3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C22H30N4O6/c1-4-31-21(28)20-19(16-14-15(30-3)6-7-17(16)23-20)24-18(27)8-9-25-10-12-26(13-11-25)22(29)32-5-2/h6-7,14,23H,4-5,8-13H2,1-3H3,(H,24,27)