[2-(3-methoxypiperazin-1-yl)-4-(phenylmethyl)phenyl]sulfamic acid

Systemtic Name: [2-(3-methoxypiperazin-1-yl)-4-(phenylmethyl)phenyl]sulfamic acid Openeye Name: [4-benzyl-2-(3-methoxypiperazin-1-yl)phenyl]sulfamic acid CAS Name: [2-(3-methoxy-1-piperazinyl)-4-(phenylmethyl)phenyl]sulfamic acid IUPAC Name: [4-benzyl-2-(3-methoxypiperazin-1-yl)phenyl]sulfamic acid Traditional Name: [4-benzyl-2-(3-methoxypiperazino)phenyl]sulfamic acid Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCN1)C2=C(C=CC(=C2)CC3=CC=CC=C3)NS(=O)(=O)O

Isomeric SMILES

COC1CN(CCN1)C2=C(C=CC(=C2)CC3=CC=CC=C3)NS(=O)(=O)O

InChI

InChI=1S/C18H23N3O4S/c1-25-18-13-21(10-9-19-18)17-12-15(11-14-5-3-2-4-6-14)7-8-16(17)20-26(22,23)24/h2-8,12,18-20H,9-11,13H2,1H3,(H,22,23,24)