methyl 2-[(2-azanylidene-6-nitro-chromen-3-yl)carbonylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-azanylidene-6-nitro-chromen-3-yl)carbonylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2-imino-6-nitro-chromene-3-carbonyl)amino]-5-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[(2-imino-6-nitro-1-benzopyran-3-yl)-oxomethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-imino-6-nitrochromene-3-carbonyl)amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[(2-imino-6-nitro-chromene-3-carbonyl)amino]-5-isopropyl-thiophene-3-carboxylic acid methyl ester Formula: C19H17N3O6S MolecularWeight: 415.41978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(S1)NC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=N)C(=O)OC

Isomeric SMILES

CC(C)C1=CC(=C(S1)NC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=N)C(=O)OC

InChI

InChI=1S/C19H17N3O6S/c1-9(2)15-8-13(19(24)27-3)18(29-15)21-17(23)12-7-10-6-11(22(25)26)4-5-14(10)28-16(12)20/h4-9,20H,1-3H3,(H,21,23)