(4S)-4-azanyl-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-azanyl-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-amino-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxo-pentanoic acid CAS Name: (4S)-4-amino-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxopentanoic acid IUPAC Name: (4S)-4-amino-5-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-5-oxopentanoic acid Traditional Name: (4S)-4-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)C(CCC(=O)O)N

Isomeric SMILES

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

InChI

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