O3-propan-2-yl O5-[1-(thiophen-2-ylmethyl)piperidin-3-yl] 2-azanyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-propan-2-yl O5-[1-(thiophen-2-ylmethyl)piperidin-3-yl] 2-azanyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-isopropyl O5-[1-(2-thienylmethyl)-3-piperidyl] 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-propan-2-yl ester O5-[1-(thiophen-2-ylmethyl)-3-piperidinyl] ester IUPAC Name: 3-O-propan-2-yl 5-O-[1-(thiophen-2-ylmethyl)piperidin-3-yl] 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-isopropyl ester O5-[1-(2-thenyl)-3-piperidyl] ester Formula: C27H32N4O6S MolecularWeight: 540.63118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)N)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC3CCCN(C3)CC4=CC=CS4

Isomeric SMILES

CC1=C(C(C(=C(N1)N)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC3CCCN(C3)CC4=CC=CS4

InChI

InChI=1S/C27H32N4O6S/c1-16(2)36-27(33)24-23(18-7-4-8-19(13-18)31(34)35)22(17(3)29-25(24)28)26(32)37-20-9-5-11-30(14-20)15-21-10-6-12-38-21/h4,6-8,10,12-13,16,20,23,29H,5,9,11,14-15,28H2,1-3H3