methyl 3-(7-azanylheptanoylamino)-2-methyl-benzoate

Systemtic Name: methyl 3-(7-azanylheptanoylamino)-2-methyl-benzoate Openeye Name: methyl 3-(7-aminoheptanoylamino)-2-methyl-benzoate CAS Name: 3-[(7-amino-1-oxoheptyl)amino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-(7-aminoheptanoylamino)-2-methylbenzoate Traditional Name: 3-(7-aminoheptanoylamino)-2-methyl-benzoic acid methyl ester Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CCCCCCN)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CCCCCCN)C(=O)OC

InChI

InChI=1S/C16H24N2O3/c1-12-13(16(20)21-2)8-7-9-14(12)18-15(19)10-5-3-4-6-11-17/h7-9H,3-6,10-11,17H2,1-2H3,(H,18,19)