methyl (2R,3S)-3-methyl-2-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]pentanoate

Systemtic Name: methyl (2R,3S)-3-methyl-2-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]pentanoate Openeye Name: methyl (2R,3S)-3-methyl-2-[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]pentanoate CAS Name: (2R,3S)-3-methyl-2-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2R,3S)-3-methyl-2-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]pentanoate Traditional Name: (2R,3S)-2-[(4-keto-3-methyl-phthalazine-1-carbonyl)amino]-3-methyl-valeric acid methyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)OC)NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C

InChI

InChI=1S/C17H21N3O4/c1-5-10(2)13(17(23)24-4)18-15(21)14-11-8-6-7-9-12(11)16(22)20(3)19-14/h6-10,13H,5H2,1-4H3,(H,18,21)/t10-,13+/m0/s1