[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)carbonylamino]-3-methyl-pentanoate

Systemtic Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)carbonylamino]-3-methyl-pentanoate Openeye Name: [2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl] 2-[(4-chlorobenzoyl)amino]-3-methyl-pentanoate CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]-3-methylpentanoic acid [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] 2-[(4-chlorobenzoyl)amino]-3-methylpentanoate Traditional Name: 2-[(4-chlorobenzoyl)amino]-3-methyl-valeric acid [2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl] ester Formula: C22H29ClN2O4 MolecularWeight: 420.92966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC(=O)NC(CC)(CC)C#C)NC(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CCC(C)C(C(=O)OCC(=O)NC(CC)(CC)C#C)NC(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C22H29ClN2O4/c1-6-15(5)19(24-20(27)16-10-12-17(23)13-11-16)21(28)29-14-18(26)25-22(7-2,8-3)9-4/h2,10-13,15,19H,6,8-9,14H2,1,3-5H3,(H,24,27)(H,25,26)