methanol; 1-[2-oxidanyl-5-(1-piperidin-3-ylbutyl)phenyl]urea; hydrochloride

Systemtic Name: methanol; 1-[2-oxidanyl-5-(1-piperidin-3-ylbutyl)phenyl]urea; hydrochloride Openeye Name: [2-hydroxy-5-[1-(3-piperidyl)butyl]phenyl]urea; methanol; hydrochloride CAS Name: [2-hydroxy-5-[1-(3-piperidinyl)butyl]phenyl]urea; methanol; hydrochloride IUPAC Name: [2-hydroxy-5-(1-piperidin-3-ylbutyl)phenyl]urea; methanol; hydrochloride Traditional Name: [2-hydroxy-5-[1-(3-piperidyl)butyl]phenyl]urea; methanol; hydrochloride Formula: C17H30ClN3O3 MolecularWeight: 359.8914

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCCNC1)C2=CC(=C(C=C2)O)NC(=O)N.CO.Cl

Isomeric SMILES

CCCC(C1CCCNC1)C2=CC(=C(C=C2)O)NC(=O)N.CO.Cl

InChI

InChI=1S/C16H25N3O2.CH4O.ClH/c1-2-4-13(12-5-3-8-18-10-12)11-6-7-15(20)14(9-11)19-16(17)21;1-2;/h6-7,9,12-13,18,20H,2-5,8,10H2,1H3,(H3,17,19,21);2H,1H3;1H