methyl 4-chloranyl-3-(3-phenylpropylamino)benzoate

Systemtic Name: methyl 4-chloranyl-3-(3-phenylpropylamino)benzoate Openeye Name: methyl 4-chloro-3-(3-phenylpropylamino)benzoate CAS Name: 4-chloro-3-(3-phenylpropylamino)benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-(3-phenylpropylamino)benzoate Traditional Name: 4-chloro-3-(3-phenylpropylamino)benzoic acid methyl ester Formula: C17H18ClNO2 MolecularWeight: 303.78332

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NCCCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NCCCC2=CC=CC=C2

InChI

InChI=1S/C17H18ClNO2/c1-21-17(20)14-9-10-15(18)16(12-14)19-11-5-8-13-6-3-2-4-7-13/h2-4,6-7,9-10,12,19H,5,8,11H2,1H3