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

Systemtic Name: ethyl 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)propanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)propanoylamino]-1H-indole-2-carboxylate CAS Name: 5-methoxy-3-[[1-oxo-3-(4-phenyl-1-piperazinyl)propyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)propanoylamino]-1H-indole-2-carboxylate Traditional Name: 5-methoxy-3-[3-(4-phenylpiperazino)propanoylamino]-1H-indole-2-carboxylic acid ethyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

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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)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O4/c1-3-33-25(31)24-23(20-17-19(32-2)9-10-21(20)26-24)27-22(30)11-12-28-13-15-29(16-14-28)18-7-5-4-6-8-18/h4-10,17,26H,3,11-16H2,1-2H3,(H,27,30)