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

Systemtic Name: (2S)-5-azanyl-2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-5-amino-2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxo-pentanoic acid CAS Name: (2S)-5-amino-2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxopentanoic acid IUPAC Name: (2S)-5-amino-2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxopentanoic acid Traditional Name: (2S)-5-amino-5-keto-2-[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(CCC(=O)N)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2CCN[C@@H](CCC(=O)N)C(=O)O

InChI

InChI=1S/C16H21N3O4/c1-23-11-2-3-13-12(8-11)10(9-19-13)6-7-18-14(16(21)22)4-5-15(17)20/h2-3,8-9,14,18-19H,4-7H2,1H3,(H2,17,20)(H,21,22)/t14-/m0/s1