1-ethyl-5-(2-hydroxyethyloxycarbonyl)-2,6-dimethyl-4-(3-nitrophenyl)-2-(phenylmethyl)-3,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 1-ethyl-5-(2-hydroxyethyloxycarbonyl)-2,6-dimethyl-4-(3-nitrophenyl)-2-(phenylmethyl)-3,4-dihydropyridine-3-carboxylic acid Openeye Name: 2-benzyl-1-ethyl-5-(2-hydroxyethoxycarbonyl)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-3-carboxylic acid CAS Name: 1-ethyl-5-[2-hydroxyethoxy(oxo)methyl]-2,6-dimethyl-4-(3-nitrophenyl)-2-(phenylmethyl)-3,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2-benzyl-1-ethyl-5-(2-hydroxyethoxycarbonyl)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-3-carboxylic acid Traditional Name: 2-benzyl-1-ethyl-5-(2-hydroxyethoxycarbonyl)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-3-carboxylic acid Formula: C26H30N2O7 MolecularWeight: 482.5256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(C(C1(C)CC2=CC=CC=C2)C(=O)O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCO)C

Isomeric SMILES

CCN1C(=C(C(C(C1(C)CC2=CC=CC=C2)C(=O)O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCO)C

InChI

InChI=1S/C26H30N2O7/c1-4-27-17(2)21(25(32)35-14-13-29)22(19-11-8-12-20(15-19)28(33)34)23(24(30)31)26(27,3)16-18-9-6-5-7-10-18/h5-12,15,22-23,29H,4,13-14,16H2,1-3H3,(H,30,31)