methyl 7-(4-aminophenyl)-3-(3-carbamimidoylphenyl)heptanoate

Systemtic Name: methyl 7-(4-aminophenyl)-3-(3-carbamimidoylphenyl)heptanoate Openeye Name: methyl 7-(4-aminophenyl)-3-(3-carbamimidoylphenyl)heptanoate CAS Name: 7-(4-aminophenyl)-3-(3-carbamimidoylphenyl)heptanoic acid methyl ester IUPAC Name: methyl 7-(4-aminophenyl)-3-(3-carbamimidoylphenyl)heptanoate Traditional Name: 3-(3-amidinophenyl)-7-(4-aminophenyl)enanthic acid methyl ester Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CCCCC1=CC=C(C=C1)N)C2=CC=CC(=C2)C(=N)N

Isomeric SMILES

COC(=O)CC(CCCCC1=CC=C(C=C1)N)C2=CC=CC(=C2)C(=N)N

InChI

InChI=1S/C21H27N3O2/c1-26-20(25)14-17(16-7-4-8-18(13-16)21(23)24)6-3-2-5-15-9-11-19(22)12-10-15/h4,7-13,17H,2-3,5-6,14,22H2,1H3,(H3,23,24)