(2S)-2-azanyl-5-(4-methoxy-7-nitro-indol-1-yl)-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-(4-methoxy-7-nitro-indol-1-yl)-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-(4-methoxy-7-nitro-indol-1-yl)-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-(4-methoxy-7-nitro-1-indolyl)-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-(4-methoxy-7-nitroindol-1-yl)-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-keto-5-(4-methoxy-7-nitro-indol-1-yl)valeric acid Formula: C14H15N3O6 MolecularWeight: 321.2854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=CN(C2=C(C=C1)[N+](=O)[O-])C(=O)CCC(C(=O)O)N

Isomeric SMILES

COC1=C2C=CN(C2=C(C=C1)[N+](=O)[O-])C(=O)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C14H15N3O6/c1-23-11-4-3-10(17(21)22)13-8(11)6-7-16(13)12(18)5-2-9(15)14(19)20/h3-4,6-7,9H,2,5,15H2,1H3,(H,19,20)/t9-/m0/s1