3-methoxy-1-[4-(phenylmethyl)-2-propan-2-ylsulfonyl-phenyl]piperazine

Systemtic Name: 3-methoxy-1-[4-(phenylmethyl)-2-propan-2-ylsulfonyl-phenyl]piperazine Openeye Name: 1-(4-benzyl-2-isopropylsulfonyl-phenyl)-3-methoxy-piperazine CAS Name: 3-methoxy-1-[4-(phenylmethyl)-2-propan-2-ylsulfonylphenyl]piperazine IUPAC Name: 1-(4-benzyl-2-propan-2-ylsulfonylphenyl)-3-methoxypiperazine Traditional Name: 1-(4-benzyl-2-isopropylsulfonyl-phenyl)-3-methoxy-piperazine Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=CC(=C1)CC2=CC=CC=C2)N3CCNC(C3)OC

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=CC(=C1)CC2=CC=CC=C2)N3CCNC(C3)OC

InChI

InChI=1S/C21H28N2O3S/c1-16(2)27(24,25)20-14-18(13-17-7-5-4-6-8-17)9-10-19(20)23-12-11-22-21(15-23)26-3/h4-10,14,16,21-22H,11-13,15H2,1-3H3