N-[azanyl-[(4-methylphenyl)methoxyamino]methylidene]naphthalene-1-carboxamide; N-methylmethanamine; hydrate; hydrochloride

Systemtic Name: N-[azanyl-[(4-methylphenyl)methoxyamino]methylidene]naphthalene-1-carboxamide; N-methylmethanamine; hydrate; hydrochloride Openeye Name: N-[amino-(p-tolylmethoxyamino)methylene]naphthalene-1-carboxamide; N-methylmethanamine; hydrate; hydrochloride CAS Name: N-[amino-[(4-methylphenyl)methoxyamino]methylidene]-1-naphthalenecarboxamide; N-methylmethanamine; hydrate; hydrochloride IUPAC Name: N-[amino-[(4-methylphenyl)methoxyamino]methylidene]naphthalene-1-carboxamide; N-methylmethanamine; hydrate; hydrochloride Traditional Name: N-[amino-[(4-methylbenzyl)oxyamino]methylene]-1-naphthamide; dimethylamine; hydrate; hydrochloride Formula: C22H29ClN4O3 MolecularWeight: 432.94366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CONC(=NC(=O)C2=CC=CC3=CC=CC=C32)N.CNC.O.Cl

Isomeric SMILES

CC1=CC=C(C=C1)CONC(=NC(=O)C2=CC=CC3=CC=CC=C32)N.CNC.O.Cl

InChI

InChI=1S/C20H19N3O2.C2H7N.ClH.H2O/c1-14-9-11-15(12-10-14)13-25-23-20(21)22-19(24)18-8-4-6-16-5-2-3-7-17(16)18;1-3-2;;/h2-12H,13H2,1H3,(H3,21,22,23,24);3H,1-2H3;1H;1H2