ethyl 3-[[4-[(4-ethanimidoylphenyl)amino]-4-oxidanylidene-butanoyl]amino]pent-4-ynoate

Systemtic Name: ethyl 3-[[4-[(4-ethanimidoylphenyl)amino]-4-oxidanylidene-butanoyl]amino]pent-4-ynoate Openeye Name: ethyl 3-[[4-(4-ethanimidoylanilino)-4-oxo-butanoyl]amino]pent-4-ynoate CAS Name: 3-[[4-[4-(1-iminoethyl)anilino]-1,4-dioxobutyl]amino]-4-pentynoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(4-ethanimidoylanilino)-4-oxobutanoyl]amino]pent-4-ynoate Traditional Name: 3-[[4-(4-acetimidoylanilino)-4-keto-butanoyl]amino]pent-4-ynoic acid ethyl ester Formula: C19H23N3O4 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O4/c1-4-15(12-19(25)26-5-2)21-17(23)10-11-18(24)22-16-8-6-14(7-9-16)13(3)20/h1,6-9,15,20H,5,10-12H2,2-3H3,(H,21,23)(H,22,24)