[4-[(6-methoxypyridin-3-yl)carbamoyl]phenyl] 3-nitrobenzenesulfonate

Systemtic Name: [4-[(6-methoxypyridin-3-yl)carbamoyl]phenyl] 3-nitrobenzenesulfonate Openeye Name: [4-[(6-methoxy-3-pyridyl)carbamoyl]phenyl] 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid [4-[[(6-methoxy-3-pyridinyl)amino]-oxomethyl]phenyl] ester IUPAC Name: [4-[(6-methoxypyridin-3-yl)carbamoyl]phenyl] 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid [4-[(6-methoxy-3-pyridyl)carbamoyl]phenyl] ester Formula: C19H15N3O7S MolecularWeight: 429.4033

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)NC(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=NC=C(C=C1)NC(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15N3O7S/c1-28-18-10-7-14(12-20-18)21-19(23)13-5-8-16(9-6-13)29-30(26,27)17-4-2-3-15(11-17)22(24)25/h2-12H,1H3,(H,21,23)