(3S)-3-[(4S)-2,2-dimethyloxan-4-yl]-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-6-methyl-heptan-1-amine

Systemtic Name: (3S)-3-[(4S)-2,2-dimethyloxan-4-yl]-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-6-methyl-heptan-1-amine Openeye Name: (3S)-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-6-methyl-heptan-1-amine CAS Name: (3S)-3-[(4S)-2,2-dimethyl-4-oxanyl]-N-[(4-ethoxy-3-methoxyphenyl)methyl]-6-methyl-1-heptanamine IUPAC Name: (3S)-3-[(4S)-2,2-dimethyloxan-4-yl]-N-[(4-ethoxy-3-methoxyphenyl)methyl]-6-methylheptan-1-amine Traditional Name: [(3S)-3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-6-methyl-heptyl]-(4-ethoxy-3-methoxy-benzyl)amine Formula: C25H43NO3 MolecularWeight: 405.61382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNCCC(CCC(C)C)C2CCOC(C2)(C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNCC[C@H](CCC(C)C)[C@H]2CCOC(C2)(C)C)OC

InChI

InChI=1S/C25H43NO3/c1-7-28-23-11-9-20(16-24(23)27-6)18-26-14-12-21(10-8-19(2)3)22-13-15-29-25(4,5)17-22/h9,11,16,19,21-22,26H,7-8,10,12-15,17-18H2,1-6H3/t21-,22-/m0/s1