methyl (2R)-2-[[(2R)-2-azanyl-3-(2-cyano-1H-indol-3-yl)propanoyl]amino]pentanoate

Systemtic Name: methyl (2R)-2-[[(2R)-2-azanyl-3-(2-cyano-1H-indol-3-yl)propanoyl]amino]pentanoate Openeye Name: methyl (2R)-2-[[(2R)-2-amino-3-(2-cyano-1H-indol-3-yl)propanoyl]amino]pentanoate CAS Name: (2R)-2-[[(2R)-2-amino-3-(2-cyano-1H-indol-3-yl)-1-oxopropyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2R)-2-amino-3-(2-cyano-1H-indol-3-yl)propanoyl]amino]pentanoate Traditional Name: (2R)-2-[[(2R)-2-amino-3-(2-cyano-1H-indol-3-yl)propanoyl]amino]valeric acid methyl ester Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC)NC(=O)C(CC1=C(NC2=CC=CC=C21)C#N)N

Isomeric SMILES

CCC[C@H](C(=O)OC)NC(=O)[C@@H](CC1=C(NC2=CC=CC=C21)C#N)N

InChI

InChI=1S/C18H22N4O3/c1-3-6-15(18(24)25-2)22-17(23)13(20)9-12-11-7-4-5-8-14(11)21-16(12)10-19/h4-5,7-8,13,15,21H,3,6,9,20H2,1-2H3,(H,22,23)/t13-,15-/m1/s1