methyl 2-azanylbenzoate; 2-methyl-3-(4-propan-2-ylphenyl)propanal

Systemtic Name: methyl 2-azanylbenzoate; 2-methyl-3-(4-propan-2-ylphenyl)propanal Openeye Name: 3-(4-isopropylphenyl)-2-methyl-propanal; methyl 2-aminobenzoate CAS Name: 2-aminobenzoic acid methyl ester; 2-methyl-3-(4-propan-2-ylphenyl)propanal IUPAC Name: methyl 2-aminobenzoate; 2-methyl-3-(4-propan-2-ylphenyl)propanal Traditional Name: 2-aminobenzoic acid methyl ester; 2-methyl-3-p-cumenyl-propionaldehyde Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC(C)C=O.COC(=O)C1=CC=CC=C1N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC(C)C=O.COC(=O)C1=CC=CC=C1N

InChI

InChI=1S/C13H18O.C8H9NO2/c1-10(2)13-6-4-12(5-7-13)8-11(3)9-14;1-11-8(10)6-4-2-3-5-7(6)9/h4-7,9-11H,8H2,1-3H3;2-5H,9H2,1H3