O3-methyl O5-pyrrolidin-3-yl 2,6-dimethyl-4-(3-nitrophenyl)-1-(phenylmethyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-pyrrolidin-3-yl 2,6-dimethyl-4-(3-nitrophenyl)-1-(phenylmethyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: O3-methyl O5-pyrrolidin-3-yl 1-benzyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1-(phenylmethyl)-4H-pyridine-3,5-dicarboxylic acid O3-methyl ester O5-(3-pyrrolidinyl) ester IUPAC Name: 3-O-methyl 5-O-pyrrolidin-3-yl 1-benzyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-benzyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid O3-methyl ester O5-pyrrolidin-3-yl ester Formula: C27H29N3O6 MolecularWeight: 491.53566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1CC2=CC=CC=C2)C)C(=O)OC3CCNC3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1CC2=CC=CC=C2)C)C(=O)OC3CCNC3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C27H29N3O6/c1-17-23(26(31)35-3)25(20-10-7-11-21(14-20)30(33)34)24(27(32)36-22-12-13-28-15-22)18(2)29(17)16-19-8-5-4-6-9-19/h4-11,14,22,25,28H,12-13,15-16H2,1-3H3