N',N'-diethyl-N-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)propane-1,3-diamine

Systemtic Name: N',N'-diethyl-N-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)propane-1,3-diamine Openeye Name: N',N'-diethyl-N-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)propane-1,3-diamine CAS Name: N',N'-diethyl-N-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)propane-1,3-diamine IUPAC Name: N',N'-diethyl-N-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)propane-1,3-diamine Traditional Name: diethyl-[3-[(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]propyl]amine Formula: C18H30N2O MolecularWeight: 290.4436

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1CCCOC2=C1C=CC=C2C

Isomeric SMILES

CCN(CC)CCCNC1CCCOC2=C1C=CC=C2C

InChI

InChI=1S/C18H30N2O/c1-4-20(5-2)13-8-12-19-17-11-7-14-21-18-15(3)9-6-10-16(17)18/h6,9-10,17,19H,4-5,7-8,11-14H2,1-3H3