ethyl (2S)-2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: ethyl (2S)-2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoate Openeye Name: ethyl (2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-3-(1H-indol-3-yl)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propionic acid ethyl ester Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C(CC(C)C)N

Isomeric SMILES

CCOC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)[C@H](CC(C)C)N

InChI

InChI=1S/C19H27N3O3/c1-4-25-19(24)17(22-18(23)15(20)9-12(2)3)10-13-11-21-16-8-6-5-7-14(13)16/h5-8,11-12,15,17,21H,4,9-10,20H2,1-3H3,(H,22,23)/t15-,17-/m0/s1