1-[2-[[1-(4-nitrooxybutoxy)-1-oxidanylidene-4-phenyl-butan-2-yl]amino]propanoyl]-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-[2-[[1-(4-nitrooxybutoxy)-1-oxidanylidene-4-phenyl-butan-2-yl]amino]propanoyl]-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-[2-[[1-(4-nitrooxybutoxycarbonyl)-3-phenyl-propyl]amino]propanoyl]indoline-2-carboxylic acid CAS Name: 1-[2-[[1-(4-nitrooxybutoxy)-1-oxo-4-phenylbutan-2-yl]amino]-1-oxopropyl]-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-[2-[[1-(4-nitrooxybutoxy)-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-[2-[[1-(4-nitrooxybutoxycarbonyl)-3-phenyl-propyl]amino]propanoyl]indoline-2-carboxylic acid Formula: C26H31N3O8 MolecularWeight: 513.53964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C(CC2=CC=CC=C21)C(=O)O)NC(CCC3=CC=CC=C3)C(=O)OCCCCO[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1C(CC2=CC=CC=C21)C(=O)O)NC(CCC3=CC=CC=C3)C(=O)OCCCCO[N+](=O)[O-]

InChI

InChI=1S/C26H31N3O8/c1-18(24(30)28-22-12-6-5-11-20(22)17-23(28)25(31)32)27-21(14-13-19-9-3-2-4-10-19)26(33)36-15-7-8-16-37-29(34)35/h2-6,9-12,18,21,23,27H,7-8,13-17H2,1H3,(H,31,32)