[4-(4-azanylbutyl)-1,4-diazepan-1-yl]-(3-hydroxyphenyl)methanone

Systemtic Name: [4-(4-azanylbutyl)-1,4-diazepan-1-yl]-(3-hydroxyphenyl)methanone Openeye Name: [4-(4-aminobutyl)-1,4-diazepan-1-yl]-(3-hydroxyphenyl)methanone CAS Name: [4-(4-aminobutyl)-1,4-diazepan-1-yl]-(3-hydroxyphenyl)methanone IUPAC Name: [4-(4-aminobutyl)-1,4-diazepan-1-yl]-(3-hydroxyphenyl)methanone Traditional Name: [4-(4-aminobutyl)-1,4-diazepan-1-yl]-(3-hydroxyphenyl)methanone Formula: C16H25N3O2 MolecularWeight: 291.3886

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC(=CC=C2)O)CCCCN

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC(=CC=C2)O)CCCCN

InChI

InChI=1S/C16H25N3O2/c17-7-1-2-8-18-9-4-10-19(12-11-18)16(21)14-5-3-6-15(20)13-14/h3,5-6,13,20H,1-2,4,7-12,17H2