methyl (2S)-2-[(3-methanoyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)-(phenylmethyl)amino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[(3-methanoyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)-(phenylmethyl)amino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[benzyl-(3-formyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[(3-formyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)-(phenylmethyl)amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[benzyl-(3-formyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[benzyl-(3-formyl-4-keto-pyrido[1,2-a]pyrimidin-2-yl)amino]-3-methyl-butyric acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)N(CC1=CC=CC=C1)C2=C(C(=O)N3C=CC=CC3=N2)C=O

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)N(CC1=CC=CC=C1)C2=C(C(=O)N3C=CC=CC3=N2)C=O

InChI

InChI=1S/C22H23N3O4/c1-15(2)19(22(28)29-3)25(13-16-9-5-4-6-10-16)20-17(14-26)21(27)24-12-8-7-11-18(24)23-20/h4-12,14-15,19H,13H2,1-3H3/t19-/m0/s1