N-(cyclohexylmethyl)-3-[(4-methylnaphthalen-1-yl)carbonylamino]-1-oxidanidyl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-(cyclohexylmethyl)-3-[(4-methylnaphthalen-1-yl)carbonylamino]-1-oxidanidyl-pyridin-1-ium-2-carboxamide Openeye Name: N-(cyclohexylmethyl)-3-[(4-methylnaphthalene-1-carbonyl)amino]-1-oxido-pyridin-1-ium-2-carboxamide CAS Name: N-(cyclohexylmethyl)-3-[[(4-methyl-1-naphthalenyl)-oxomethyl]amino]-1-oxido-2-pyridin-1-iumcarboxamide IUPAC Name: N-(cyclohexylmethyl)-3-[(4-methylnaphthalene-1-carbonyl)amino]-1-oxidopyridin-1-ium-2-carboxamide Traditional Name: N-(cyclohexylmethyl)-3-[(4-methyl-1-naphthoyl)amino]-1-oxido-pyridin-1-ium-2-carboxamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=CC=CC=C12)C(=O)NC3=C([N+](=CC=C3)[O-])C(=O)NCC4CCCCC4

Isomeric SMILES

CC1=CC=C(C2=CC=CC=C12)C(=O)NC3=C([N+](=CC=C3)[O-])C(=O)NCC4CCCCC4

InChI

InChI=1S/C25H27N3O3/c1-17-13-14-21(20-11-6-5-10-19(17)20)24(29)27-22-12-7-15-28(31)23(22)25(30)26-16-18-8-3-2-4-9-18/h5-7,10-15,18H,2-4,8-9,16H2,1H3,(H,26,30)(H,27,29)