(2S)-2-azanyl-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-keto-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]valeric acid Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2CCNC(=O)CCC(C(=O)O)N

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2CCNC(=O)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C16H21N3O4/c1-23-11-2-4-14-12(8-11)10(9-19-14)6-7-18-15(20)5-3-13(17)16(21)22/h2,4,8-9,13,19H,3,5-7,17H2,1H3,(H,18,20)(H,21,22)/t13-/m0/s1