(4S)-4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxamide

Systemtic Name: (4S)-4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxamide Openeye Name: (4S)-4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxamide CAS Name: (4S)-4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxamide IUPAC Name: (4S)-4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxamide Traditional Name: (4S)-4-(1,3-benzodioxol-5-yl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxamide Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)N)C2=CC3=C(C=C2)OCO3)C(=O)N)C

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)N)C2=CC3=C(C=C2)OCO3)C(=O)N)C

InChI

InChI=1S/C16H17N3O4/c1-7-12(15(17)20)14(13(16(18)21)8(2)19-7)9-3-4-10-11(5-9)23-6-22-10/h3-5,12,14H,6H2,1-2H3,(H2,17,20)(H2,18,21)/t12?,14-/m1/s1