(3S)-3-azanyl-4-oxidanylidene-4-[(2S)-2-(quinolin-6-ylcarbamoyl)pyrrolidin-1-yl]butanoic acid

Systemtic Name: (3S)-3-azanyl-4-oxidanylidene-4-[(2S)-2-(quinolin-6-ylcarbamoyl)pyrrolidin-1-yl]butanoic acid Openeye Name: (3S)-3-amino-4-oxo-4-[(2S)-2-(6-quinolylcarbamoyl)pyrrolidin-1-yl]butanoic acid CAS Name: (3S)-3-amino-4-oxo-4-[(2S)-2-[oxo-(6-quinolinylamino)methyl]-1-pyrrolidinyl]butanoic acid IUPAC Name: (3S)-3-amino-4-oxo-4-[(2S)-2-(quinolin-6-ylcarbamoyl)pyrrolidin-1-yl]butanoic acid Traditional Name: (3S)-3-amino-4-keto-4-[(2S)-2-(6-quinolylcarbamoyl)pyrrolidino]butyric acid Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC(=O)O)N)C(=O)NC2=CC3=C(C=C2)N=CC=C3

Isomeric SMILES

C1C[C@H](N(C1)C(=O)[C@H](CC(=O)O)N)C(=O)NC2=CC3=C(C=C2)N=CC=C3

InChI

InChI=1S/C18H20N4O4/c19-13(10-16(23)24)18(26)22-8-2-4-15(22)17(25)21-12-5-6-14-11(9-12)3-1-7-20-14/h1,3,5-7,9,13,15H,2,4,8,10,19H2,(H,21,25)(H,23,24)/t13-,15-/m0/s1