N-(5-butyl-2-phenylmethoxy-phenyl)methanamide; propan-2-amine

Systemtic Name: N-(5-butyl-2-phenylmethoxy-phenyl)methanamide; propan-2-amine Openeye Name: N-(2-benzyloxy-5-butyl-phenyl)formamide; propan-2-amine CAS Name: N-(5-butyl-2-phenylmethoxyphenyl)formamide; 2-propanamine IUPAC Name: N-(5-butyl-2-phenylmethoxyphenyl)formamide; propan-2-amine Traditional Name: N-(2-benzoxy-5-butyl-phenyl)formamide; isopropylamine Formula: C21H30N2O2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)OCC2=CC=CC=C2)NC=O.CC(C)N

Isomeric SMILES

CCCCC1=CC(=C(C=C1)OCC2=CC=CC=C2)NC=O.CC(C)N

InChI

InChI=1S/C18H21NO2.C3H9N/c1-2-3-7-15-10-11-18(17(12-15)19-14-20)21-13-16-8-5-4-6-9-16;1-3(2)4/h4-6,8-12,14H,2-3,7,13H2,1H3,(H,19,20);3H,4H2,1-2H3