2-[3-(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-oxidanyl-propoxy]phenol

Systemtic Name: 2-[3-(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-oxidanyl-propoxy]phenol Openeye Name: 2-[3-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-hydroxy-propoxy]phenol CAS Name: 2-[3-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-hydroxypropoxy]phenol IUPAC Name: 2-[3-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-hydroxypropoxy]phenol Traditional Name: 2-[3-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-hydroxy-propoxy]phenol Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NC(C1)CC(COC2=CC=CC=C2O)O)N

Isomeric SMILES

C1CCC(=NC(C1)CC(COC2=CC=CC=C2O)O)N

InChI

InChI=1S/C15H22N2O3/c16-15-8-4-1-5-11(17-15)9-12(18)10-20-14-7-3-2-6-13(14)19/h2-3,6-7,11-12,18-19H,1,4-5,8-10H2,(H2,16,17)