(3R)-2-[ethoxy-(4-methoxyphenyl)phosphoryl]-7-nitro-N-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-[ethoxy-(4-methoxyphenyl)phosphoryl]-7-nitro-N-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-[ethoxy-(4-methoxyphenyl)phosphoryl]-7-nitro-3,4-dihydro-1H-isoquinoline-3-carbohydroxamic acid CAS Name: (3R)-2-[ethoxy-(4-methoxyphenyl)phosphoryl]-N-hydroxy-7-nitro-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-[ethoxy-(4-methoxyphenyl)phosphoryl]-N-hydroxy-7-nitro-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-[ethoxy-(4-methoxyphenyl)phosphoryl]-7-nitro-3,4-dihydro-1H-isoquinoline-3-carbohydroxamic acid Formula: C19H22N3O7P MolecularWeight: 435.367641

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC=C(C=C1)OC)N2CC3=C(CC2C(=O)NO)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCO[P@@](=O)(C1=CC=C(C=C1)OC)N2CC3=C(C[C@@H]2C(=O)NO)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N3O7P/c1-3-29-30(27,17-8-6-16(28-2)7-9-17)21-12-14-10-15(22(25)26)5-4-13(14)11-18(21)19(23)20-24/h4-10,18,24H,3,11-12H2,1-2H3,(H,20,23)/t18-,30+/m1/s1