ethyl cyclohexene-1-carboxylate; 1-nitro-4-(sulfinoamino)benzene

Systemtic Name: ethyl cyclohexene-1-carboxylate; 1-nitro-4-(sulfinoamino)benzene Openeye Name: ethyl cyclohexene-1-carboxylate; 1-nitro-4-(sulfinoamino)benzene CAS Name: 1-cyclohexenecarboxylic acid ethyl ester; 1-nitro-4-(sulfinoamino)benzene IUPAC Name: ethyl cyclohexene-1-carboxylate; 1-nitro-4-(sulfinoamino)benzene Traditional Name: cyclohexene-1-carboxylic acid ethyl ester; 1-nitro-4-(sulfinoamino)benzene Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CCCCC1.C1=CC(=CC=C1NS(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CCCCC1.C1=CC(=CC=C1NS(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H14O2.C6H6N2O4S/c1-2-11-9(10)8-6-4-3-5-7-8;9-8(10)6-3-1-5(2-4-6)7-13(11)12/h6H,2-5,7H2,1H3;1-4,7H,(H,11,12)