2-[7-(aminomethyl)-8,9-dihydro-5H-benzo[7]annulen-9-yl]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[7-(aminomethyl)-8,9-dihydro-5H-benzo[7]annulen-9-yl]-3,3-dimethyl-butanoic acid Openeye Name: 2-[7-(aminomethyl)-8,9-dihydro-5H-benzo[7]annulen-9-yl]-3,3-dimethyl-butanoic acid CAS Name: 2-[7-(aminomethyl)-8,9-dihydro-5H-benzo[7]annulen-9-yl]-3,3-dimethylbutanoic acid IUPAC Name: 2-[7-(aminomethyl)-8,9-dihydro-5H-benzo[7]annulen-9-yl]-3,3-dimethylbutanoic acid Traditional Name: 2-[7-(aminomethyl)-8,9-dihydro-5H-benzocyclohepten-9-yl]-3,3-dimethyl-butyric acid Formula: C18H25NO2 MolecularWeight: 287.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C1CC(=CCC2=CC=CC=C12)CN)C(=O)O

Isomeric SMILES

CC(C)(C)C(C1CC(=CCC2=CC=CC=C12)CN)C(=O)O

InChI

InChI=1S/C18H25NO2/c1-18(2,3)16(17(20)21)15-10-12(11-19)8-9-13-6-4-5-7-14(13)15/h4-8,15-16H,9-11,19H2,1-3H3,(H,20,21)