2-azanyl-4-methyl-3-phenethyl-benzoate

Systemtic Name: 2-azanyl-4-methyl-3-phenethyl-benzoate Openeye Name: 2-amino-4-methyl-3-phenethyl-benzoate CAS Name: 2-amino-4-methyl-3-phenethylbenzoate IUPAC Name: 2-amino-4-methyl-3-phenethylbenzoate Traditional Name: 2-amino-4-methyl-3-phenethyl-benzoate Formula: C16H16NO2- MolecularWeight: 254.30374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)[O-])N)CCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)[O-])N)CCC2=CC=CC=C2

InChI

InChI=1S/C16H17NO2/c1-11-7-9-14(16(18)19)15(17)13(11)10-8-12-5-3-2-4-6-12/h2-7,9H,8,10,17H2,1H3,(H,18,19)/p-1