4-(4-ethoxyphenyl)sulfonyl-N-[(3-methoxyphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-ethoxyphenyl)sulfonyl-N-[(3-methoxyphenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-(4-ethoxyphenyl)sulfonyl-N-[(3-methoxyphenyl)methyl]piperazine-1-carboxamide CAS Name: 4-(4-ethoxyphenyl)sulfonyl-N-[(3-methoxyphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-ethoxyphenyl)sulfonyl-N-[(3-methoxyphenyl)methyl]piperazine-1-carboxamide Traditional Name: N-m-anisyl-4-p-phenetylsulfonyl-piperazine-1-carboxamide Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H27N3O5S/c1-3-29-18-7-9-20(10-8-18)30(26,27)24-13-11-23(12-14-24)21(25)22-16-17-5-4-6-19(15-17)28-2/h4-10,15H,3,11-14,16H2,1-2H3,(H,22,25)