methyl 2-[(4-azanyl-2-prop-1-ynyl-phenyl)carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[(4-azanyl-2-prop-1-ynyl-phenyl)carbonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[(4-amino-2-prop-1-ynyl-benzoyl)amino]-4-methyl-pentanoate CAS Name: 2-[[(4-amino-2-prop-1-ynylphenyl)-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(4-amino-2-prop-1-ynylbenzoyl)amino]-4-methylpentanoate Traditional Name: 2-[(4-amino-2-prop-1-ynyl-benzoyl)amino]-4-methyl-valeric acid methyl ester Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=C(C=CC(=C1)N)C(=O)NC(CC(C)C)C(=O)OC

Isomeric SMILES

CC#CC1=C(C=CC(=C1)N)C(=O)NC(CC(C)C)C(=O)OC

InChI

InChI=1S/C17H22N2O3/c1-5-6-12-10-13(18)7-8-14(12)16(20)19-15(9-11(2)3)17(21)22-4/h7-8,10-11,15H,9,18H2,1-4H3,(H,19,20)