ethyl 3,5-bis(4-carbamimidoylphenyl)pentanoate

Systemtic Name: ethyl 3,5-bis(4-carbamimidoylphenyl)pentanoate Openeye Name: ethyl 3,5-bis(4-carbamimidoylphenyl)pentanoate CAS Name: 3,5-bis(4-carbamimidoylphenyl)pentanoic acid ethyl ester IUPAC Name: ethyl 3,5-bis(4-carbamimidoylphenyl)pentanoate Traditional Name: 3,5-bis(4-amidinophenyl)valeric acid ethyl ester Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CCC1=CC=C(C=C1)C(=N)N)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(=O)CC(CCC1=CC=C(C=C1)C(=N)N)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C21H26N4O2/c1-2-27-19(26)13-18(15-9-11-17(12-10-15)21(24)25)8-5-14-3-6-16(7-4-14)20(22)23/h3-4,6-7,9-12,18H,2,5,8,13H2,1H3,(H3,22,23)(H3,24,25)