(2S)-1-[(2S)-2-azanylbutanoyl]-2,3-dihydrobenzo[f]indole-2-carboxylic acid

Systemtic Name: (2S)-1-[(2S)-2-azanylbutanoyl]-2,3-dihydrobenzo[f]indole-2-carboxylic acid Openeye Name: (2S)-1-[(2S)-2-aminobutanoyl]-2,3-dihydrobenzo[f]indole-2-carboxylic acid CAS Name: (2S)-1-[(2S)-2-amino-1-oxobutyl]-2,3-dihydrobenzo[f]indole-2-carboxylic acid IUPAC Name: (2S)-1-[(2S)-2-aminobutanoyl]-2,3-dihydrobenzo[f]indole-2-carboxylic acid Traditional Name: (2S)-1-[(2S)-2-aminobutanoyl]-2,3-dihydrobenz[f]indole-2-carboxylic acid Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C(CC2=CC3=CC=CC=C3C=C21)C(=O)O)N

Isomeric SMILES

CC[C@@H](C(=O)N1[C@@H](CC2=CC3=CC=CC=C3C=C21)C(=O)O)N

InChI

InChI=1S/C17H18N2O3/c1-2-13(18)16(20)19-14-8-11-6-4-3-5-10(11)7-12(14)9-15(19)17(21)22/h3-8,13,15H,2,9,18H2,1H3,(H,21,22)/t13-,15-/m0/s1