N-butyl-N-methyl-butan-1-amine; (4-decoxy-2-oxidanyl-phenyl)-phenyl-methanone

Systemtic Name: N-butyl-N-methyl-butan-1-amine; (4-decoxy-2-oxidanyl-phenyl)-phenyl-methanone Openeye Name: N-butyl-N-methyl-butan-1-amine; (4-decoxy-2-hydroxy-phenyl)-phenyl-methanone CAS Name: N-butyl-N-methyl-1-butanamine; (4-decoxy-2-hydroxyphenyl)-phenylmethanone IUPAC Name: N-butyl-N-methylbutan-1-amine; (4-decoxy-2-hydroxyphenyl)-phenylmethanone Traditional Name: (4-decoxy-2-hydroxy-phenyl)-phenyl-methanone; dibutyl(methyl)amine Formula: C32H51NO3 MolecularWeight: 497.75224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O.CCCCN(C)CCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O.CCCCN(C)CCCC

InChI

InChI=1S/C23H30O3.C9H21N/c1-2-3-4-5-6-7-8-12-17-26-20-15-16-21(22(24)18-20)23(25)19-13-10-9-11-14-19;1-4-6-8-10(3)9-7-5-2/h9-11,13-16,18,24H,2-8,12,17H2,1H3;4-9H2,1-3H3