dimethyl 2,6-dimethyl-4-[3-(3-piperazin-1-ylpropylcarbamoylamino)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2,6-dimethyl-4-[3-(3-piperazin-1-ylpropylcarbamoylamino)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 2,6-dimethyl-4-[3-(3-piperazin-1-ylpropylcarbamoylamino)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-[3-[[oxo-[3-(1-piperazinyl)propylamino]methyl]amino]phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,6-dimethyl-4-[3-(3-piperazin-1-ylpropylcarbamoylamino)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-[3-(3-piperazinopropylcarbamoylamino)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C25H35N5O5 MolecularWeight: 485.5759

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC(=CC=C2)NC(=O)NCCCN3CCNCC3)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC(=CC=C2)NC(=O)NCCCN3CCNCC3)C(=O)OC

InChI

InChI=1S/C25H35N5O5/c1-16-20(23(31)34-3)22(21(17(2)28-16)24(32)35-4)18-7-5-8-19(15-18)29-25(33)27-9-6-12-30-13-10-26-11-14-30/h5,7-8,15,22,26,28H,6,9-14H2,1-4H3,(H2,27,29,33)