N-[[2-(2-azanyl-2-oxidanylidene-ethoxy)-4-carbamimidoyl-phenyl]methyl]-3-methyl-benzamide hydrochloride

Systemtic Name: N-[[2-(2-azanyl-2-oxidanylidene-ethoxy)-4-carbamimidoyl-phenyl]methyl]-3-methyl-benzamide hydrochloride Openeye Name: N-[[2-(2-amino-2-oxo-ethoxy)-4-carbamimidoyl-phenyl]methyl]-3-methyl-benzamide hydrochloride CAS Name: N-[[2-(2-amino-2-oxoethoxy)-4-carbamimidoylphenyl]methyl]-3-methylbenzamide hydrochloride IUPAC Name: N-[[2-(2-amino-2-oxoethoxy)-4-carbamimidoylphenyl]methyl]-3-methylbenzamide hydrochloride Traditional Name: N-[4-amidino-2-(2-amino-2-keto-ethoxy)benzyl]-3-methyl-benzamide hydrochloride Formula: C18H21ClN4O3 MolecularWeight: 376.83734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC(=O)N.Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC(=O)N.Cl

InChI

InChI=1S/C18H20N4O3.ClH/c1-11-3-2-4-13(7-11)18(24)22-9-14-6-5-12(17(20)21)8-15(14)25-10-16(19)23;/h2-8H,9-10H2,1H3,(H2,19,23)(H3,20,21)(H,22,24);1H