3-benzamidopropyl 4-methylbenzenesulfonate

Systemtic Name: 3-benzamidopropyl 4-methylbenzenesulfonate Openeye Name: 3-benzamidopropyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-benzamidopropyl ester IUPAC Name: 3-benzamidopropyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-benzamidopropyl ester Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCNC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCNC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H19NO4S/c1-14-8-10-16(11-9-14)23(20,21)22-13-5-12-18-17(19)15-6-3-2-4-7-15/h2-4,6-11H,5,12-13H2,1H3,(H,18,19)