[3-[ethyl(pyridin-4-ylmethyl)amino]-3-oxidanylidene-2-phenyl-propyl] 4-(3,5-dimethoxyphenyl)piperazine-1-carboxylate

Systemtic Name: [3-[ethyl(pyridin-4-ylmethyl)amino]-3-oxidanylidene-2-phenyl-propyl] 4-(3,5-dimethoxyphenyl)piperazine-1-carboxylate Openeye Name: [3-[ethyl(4-pyridylmethyl)amino]-3-oxo-2-phenyl-propyl] 4-(3,5-dimethoxyphenyl)piperazine-1-carboxylate CAS Name: 4-(3,5-dimethoxyphenyl)-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-(3,5-dimethoxyphenyl)piperazine-1-carboxylate Traditional Name: 4-(3,5-dimethoxyphenyl)piperazine-1-carboxylic acid [3-[ethyl(4-pyridylmethyl)amino]-3-keto-2-phenyl-propyl] ester Formula: C30H36N4O5 MolecularWeight: 532.63064

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C(=O)C(COC(=O)N2CCN(CC2)C3=CC(=CC(=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

CCN(CC1=CC=NC=C1)C(=O)C(COC(=O)N2CCN(CC2)C3=CC(=CC(=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C30H36N4O5/c1-4-32(21-23-10-12-31-13-11-23)29(35)28(24-8-6-5-7-9-24)22-39-30(36)34-16-14-33(15-17-34)25-18-26(37-2)20-27(19-25)38-3/h5-13,18-20,28H,4,14-17,21-22H2,1-3H3