[3-[ethyl(pyridin-4-ylmethyl)amino]-3-oxidanylidene-2-phenyl-propyl] 4-(1H-indol-4-yl)piperazine-1-carboxylate

Systemtic Name: [3-[ethyl(pyridin-4-ylmethyl)amino]-3-oxidanylidene-2-phenyl-propyl] 4-(1H-indol-4-yl)piperazine-1-carboxylate Openeye Name: [3-[ethyl(4-pyridylmethyl)amino]-3-oxo-2-phenyl-propyl] 4-(1H-indol-4-yl)piperazine-1-carboxylate CAS Name: 4-(1H-indol-4-yl)-1-piperazinecarboxylic acid [3-[ethyl(pyridin-4-ylmethyl)amino]-3-oxo-2-phenylpropyl] ester IUPAC Name: [3-[ethyl(pyridin-4-ylmethyl)amino]-3-oxo-2-phenylpropyl] 4-(1H-indol-4-yl)piperazine-1-carboxylate Traditional Name: 4-(1H-indol-4-yl)piperazine-1-carboxylic acid [3-[ethyl(4-pyridylmethyl)amino]-3-keto-2-phenyl-propyl] ester Formula: C30H33N5O3 MolecularWeight: 511.61472

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C(=O)C(COC(=O)N2CCN(CC2)C3=CC=CC4=C3C=CN4)C5=CC=CC=C5

Isomeric SMILES

CCN(CC1=CC=NC=C1)C(=O)C(COC(=O)N2CCN(CC2)C3=CC=CC4=C3C=CN4)C5=CC=CC=C5

InChI

InChI=1S/C30H33N5O3/c1-2-33(21-23-11-14-31-15-12-23)29(36)26(24-7-4-3-5-8-24)22-38-30(37)35-19-17-34(18-20-35)28-10-6-9-27-25(28)13-16-32-27/h3-16,26,32H,2,17-22H2,1H3