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

Systemtic Name: N-(cyclobutylmethyl)-3-[(4-methoxynaphthalen-1-yl)carbonylamino]-1-oxidanidyl-pyridin-1-ium-2-carboxamide Openeye Name: N-(cyclobutylmethyl)-3-[(4-methoxynaphthalene-1-carbonyl)amino]-1-oxido-pyridin-1-ium-2-carboxamide CAS Name: N-(cyclobutylmethyl)-3-[[(4-methoxy-1-naphthalenyl)-oxomethyl]amino]-1-oxido-2-pyridin-1-iumcarboxamide IUPAC Name: N-(cyclobutylmethyl)-3-[(4-methoxynaphthalene-1-carbonyl)amino]-1-oxidopyridin-1-ium-2-carboxamide Traditional Name: N-(cyclobutylmethyl)-3-[(4-methoxy-1-naphthoyl)amino]-1-oxido-pyridin-1-ium-2-carboxamide Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C2=CC=CC=C21)C(=O)NC3=C([N+](=CC=C3)[O-])C(=O)NCC4CCC4

Isomeric SMILES

COC1=CC=C(C2=CC=CC=C21)C(=O)NC3=C([N+](=CC=C3)[O-])C(=O)NCC4CCC4

InChI

InChI=1S/C23H23N3O4/c1-30-20-12-11-18(16-8-2-3-9-17(16)20)22(27)25-19-10-5-13-26(29)21(19)23(28)24-14-15-6-4-7-15/h2-3,5,8-13,15H,4,6-7,14H2,1H3,(H,24,28)(H,25,27)