methyl 4-[4-(4-carbamimidoylphenyl)phenyl]butanoate; N-methylmethanamide

Systemtic Name: methyl 4-[4-(4-carbamimidoylphenyl)phenyl]butanoate; N-methylmethanamide Openeye Name: methyl 4-[4-(4-carbamimidoylphenyl)phenyl]butanoate; N-methylformamide CAS Name: 4-[4-(4-carbamimidoylphenyl)phenyl]butanoic acid methyl ester; N-methylformamide IUPAC Name: methyl 4-[4-(4-carbamimidoylphenyl)phenyl]butanoate; N-methylformamide Traditional Name: 4-[4-(4-amidinophenyl)phenyl]butyric acid methyl ester; N-methylformamide Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CNC=O.COC(=O)CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CNC=O.COC(=O)CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C18H20N2O2.C2H5NO/c1-22-17(21)4-2-3-13-5-7-14(8-6-13)15-9-11-16(12-10-15)18(19)20;1-3-2-4/h5-12H,2-4H2,1H3,(H3,19,20);2H,1H3,(H,3,4)