O5-[1-(furan-2-yl)-2-piperidin-1-yl-ethyl] O3-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-[1-(furan-2-yl)-2-piperidin-1-yl-ethyl] O3-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-[1-(2-furyl)-2-(1-piperidyl)ethyl] O3-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[1-(2-furanyl)-2-(1-piperidinyl)ethyl] ester O3-methyl ester IUPAC Name: 5-O-[1-(furan-2-yl)-2-piperidin-1-ylethyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[1-(2-furyl)-2-piperidino-ethyl] ester O3-methyl ester Formula: C27H31N3O7 MolecularWeight: 509.55094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC(CN2CCCCC2)C3=CC=CO3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC(CN2CCCCC2)C3=CC=CO3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C27H31N3O7/c1-17-23(26(31)35-3)25(19-9-7-10-20(15-19)30(33)34)24(18(2)28-17)27(32)37-22(21-11-8-14-36-21)16-29-12-5-4-6-13-29/h7-11,14-15,22,25,28H,4-6,12-13,16H2,1-3H3