10-(carboxymethyl)-2-methyl-1-oxidanylidene-4,5-dihydro-3H-azepino[3,4-b]indole-9-carboxylic acid

Systemtic Name: 10-(carboxymethyl)-2-methyl-1-oxidanylidene-4,5-dihydro-3H-azepino[3,4-b]indole-9-carboxylic acid Openeye Name: 10-(carboxymethyl)-2-methyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indole-9-carboxylic acid CAS Name: 10-(carboxymethyl)-2-methyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indole-9-carboxylic acid IUPAC Name: 10-(carboxymethyl)-2-methyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indole-9-carboxylic acid Traditional Name: 10-(carboxymethyl)-1-keto-2-methyl-4,5-dihydro-3H-azepin[3,4-b]indole-9-carboxylic acid Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC2=C(C1=O)N(C3=C2C=CC=C3C(=O)O)CC(=O)O

Isomeric SMILES

CN1CCCC2=C(C1=O)N(C3=C2C=CC=C3C(=O)O)CC(=O)O

InChI

InChI=1S/C16H16N2O5/c1-17-7-3-6-10-9-4-2-5-11(16(22)23)13(9)18(8-12(19)20)14(10)15(17)21/h2,4-5H,3,6-8H2,1H3,(H,19,20)(H,22,23)