3-(6-methylpyridin-2-yl)propyl 4-[[2-[(4-methoxyphenyl)methylamino]pyridin-3-yl]methyl]piperazine-1-carboxylate

Systemtic Name: 3-(6-methylpyridin-2-yl)propyl 4-[[2-[(4-methoxyphenyl)methylamino]pyridin-3-yl]methyl]piperazine-1-carboxylate Openeye Name: 3-(6-methyl-2-pyridyl)propyl 4-[[2-[(4-methoxyphenyl)methylamino]-3-pyridyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[2-[(4-methoxyphenyl)methylamino]-3-pyridinyl]methyl]-1-piperazinecarboxylic acid 3-(6-methyl-2-pyridinyl)propyl ester IUPAC Name: 3-(6-methylpyridin-2-yl)propyl 4-[[2-[(4-methoxyphenyl)methylamino]pyridin-3-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[2-(p-anisylamino)-3-pyridyl]methyl]piperazine-1-carboxylic acid 3-(6-methyl-2-pyridyl)propyl ester Formula: C28H35N5O3 MolecularWeight: 489.6092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CCCOC(=O)N2CCN(CC2)CC3=C(N=CC=C3)NCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC(=CC=C1)CCCOC(=O)N2CCN(CC2)CC3=C(N=CC=C3)NCC4=CC=C(C=C4)OC

InChI

InChI=1S/C28H35N5O3/c1-22-6-3-8-25(31-22)9-5-19-36-28(34)33-17-15-32(16-18-33)21-24-7-4-14-29-27(24)30-20-23-10-12-26(35-2)13-11-23/h3-4,6-8,10-14H,5,9,15-21H2,1-2H3,(H,29,30)