ethyl 3-[[4-[(4-carbamimidoylphenyl)amino]-4-oxidanylidene-butanoyl]amino]-5-methoxy-pent-4-ynoate

Systemtic Name: ethyl 3-[[4-[(4-carbamimidoylphenyl)amino]-4-oxidanylidene-butanoyl]amino]-5-methoxy-pent-4-ynoate Openeye Name: ethyl 3-[[4-(4-carbamimidoylanilino)-4-oxo-butanoyl]amino]-5-methoxy-pent-4-ynoate CAS Name: 3-[[4-(4-carbamimidoylanilino)-1,4-dioxobutyl]amino]-5-methoxy-4-pentynoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(4-carbamimidoylanilino)-4-oxobutanoyl]amino]-5-methoxypent-4-ynoate Traditional Name: 3-[[4-(4-amidinoanilino)-4-keto-butanoyl]amino]-5-methoxy-pent-4-ynoic acid ethyl ester Formula: C19H24N4O5 MolecularWeight: 388.41766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C#COC)NC(=O)CCC(=O)NC1=CC=C(C=C1)C(=N)N

Isomeric SMILES

CCOC(=O)CC(C#COC)NC(=O)CCC(=O)NC1=CC=C(C=C1)C(=N)N

InChI

InChI=1S/C19H24N4O5/c1-3-28-18(26)12-15(10-11-27-2)23-17(25)9-8-16(24)22-14-6-4-13(5-7-14)19(20)21/h4-7,15H,3,8-9,12H2,1-2H3,(H3,20,21)(H,22,24)(H,23,25)