2-(7-chloranyl-1-methyl-10-oxidanylidene-4,5-dihydro-1H-cyclohepta[b]indol-2-yl)propanoic acid

Systemtic Name: 2-(7-chloranyl-1-methyl-10-oxidanylidene-4,5-dihydro-1H-cyclohepta[b]indol-2-yl)propanoic acid Openeye Name: 2-(7-chloro-1-methyl-10-oxo-4,5-dihydro-1H-cyclohepta[b]indol-2-yl)propanoic acid CAS Name: 2-(7-chloro-1-methyl-10-oxo-4,5-dihydro-1H-cyclohepta[b]indol-2-yl)propanoic acid IUPAC Name: 2-(7-chloro-1-methyl-10-oxo-4,5-dihydro-1H-cyclohepta[b]indol-2-yl)propanoic acid Traditional Name: 2-(7-chloro-10-keto-1-methyl-4,5-dihydro-1H-cyclohept[b]indol-2-yl)propionic acid Formula: C17H16ClNO3 MolecularWeight: 317.76684

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=CCC2=C1C3=C(N2)C=C(C=CC3=O)Cl)C(C)C(=O)O

Isomeric SMILES

CC1C(=CCC2=C1C3=C(N2)C=C(C=CC3=O)Cl)C(C)C(=O)O

InChI

InChI=1S/C17H16ClNO3/c1-8-11(9(2)17(21)22)4-5-12-15(8)16-13(19-12)7-10(18)3-6-14(16)20/h3-4,6-9,19H,5H2,1-2H3,(H,21,22)