methyl 4-methoxy-3-[3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate

Systemtic Name: methyl 4-methoxy-3-[3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate Openeye Name: methyl 3-[3-[4-[(E)-cinnamyl]piperazin-1-yl]propanoylamino]-4-methoxy-1H-indole-2-carboxylate CAS Name: 4-methoxy-3-[[1-oxo-3-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]propyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-methoxy-3-[3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate Traditional Name: 3-[3-[4-[(E)-cinnamyl]piperazino]propanoylamino]-4-methoxy-1H-indole-2-carboxylic acid methyl ester Formula: C27H32N4O4 MolecularWeight: 476.56738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=C(N2)C(=O)OC)NC(=O)CCN3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC2=C1C(=C(N2)C(=O)OC)NC(=O)CCN3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H32N4O4/c1-34-22-12-6-11-21-24(22)25(26(28-21)27(33)35-2)29-23(32)13-15-31-18-16-30(17-19-31)14-7-10-20-8-4-3-5-9-20/h3-12,28H,13-19H2,1-2H3,(H,29,32)/b10-7+