N-[(4-carbamimidoylphenyl)methyl]-2-methoxy-2-(3-nitrophenyl)ethanamide hydrochloride

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-methoxy-2-(3-nitrophenyl)ethanamide hydrochloride Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-methoxy-2-(3-nitrophenyl)acetamide hydrochloride CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-methoxy-2-(3-nitrophenyl)acetamide hydrochloride IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-methoxy-2-(3-nitrophenyl)acetamide hydrochloride Traditional Name: N-(4-amidinobenzyl)-2-methoxy-2-(3-nitrophenyl)acetamide hydrochloride Formula: C17H19ClN4O4 MolecularWeight: 378.81016

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC(=CC=C1)[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)C(=N)N.Cl

Isomeric SMILES

COC(C1=CC(=CC=C1)[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)C(=N)N.Cl

InChI

InChI=1S/C17H18N4O4.ClH/c1-25-15(13-3-2-4-14(9-13)21(23)24)17(22)20-10-11-5-7-12(8-6-11)16(18)19;/h2-9,15H,10H2,1H3,(H3,18,19)(H,20,22);1H