diethyl 2-[[(2-hydroxyphenyl)carbonylamino]methylsulfanylmethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-[[(2-hydroxyphenyl)carbonylamino]methylsulfanylmethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2-[[(2-hydroxybenzoyl)amino]methylsulfanylmethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[[[[(2-hydroxyphenyl)-oxomethyl]amino]methylthio]methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[[(2-hydroxybenzoyl)amino]methylsulfanylmethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-methyl-4-(3-nitrophenyl)-6-[[(salicyloylamino)methylthio]methyl]-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C27H29N3O8S MolecularWeight: 555.59946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)CSCNC(=O)C3=CC=CC=C3O)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)CSCNC(=O)C3=CC=CC=C3O)C

InChI

InChI=1S/C27H29N3O8S/c1-4-37-26(33)22-16(3)29-20(14-39-15-28-25(32)19-11-6-7-12-21(19)31)24(27(34)38-5-2)23(22)17-9-8-10-18(13-17)30(35)36/h6-13,23,29,31H,4-5,14-15H2,1-3H3,(H,28,32)