methyl 3-chloranyl-4-[4-[(phenylmethyl)amino]phenoxy]benzoate

Systemtic Name: methyl 3-chloranyl-4-[4-[(phenylmethyl)amino]phenoxy]benzoate Openeye Name: methyl 4-[4-(benzylamino)phenoxy]-3-chloro-benzoate CAS Name: 3-chloro-4-[4-[(phenylmethyl)amino]phenoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(benzylamino)phenoxy]-3-chlorobenzoate Traditional Name: 4-[4-(benzylamino)phenoxy]-3-chloro-benzoic acid methyl ester Formula: C21H18ClNO3 MolecularWeight: 367.82552

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)NCC3=CC=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)NCC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H18ClNO3/c1-25-21(24)16-7-12-20(19(22)13-16)26-18-10-8-17(9-11-18)23-14-15-5-3-2-4-6-15/h2-13,23H,14H2,1H3