ethyl (3S)-7-chloranyl-3-[(4-methoxyphenyl)methyl-[(1S)-1-phenylethyl]amino]heptanoate

Systemtic Name: ethyl (3S)-7-chloranyl-3-[(4-methoxyphenyl)methyl-[(1S)-1-phenylethyl]amino]heptanoate Openeye Name: ethyl (3S)-7-chloro-3-[(4-methoxyphenyl)methyl-[(1S)-1-phenylethyl]amino]heptanoate CAS Name: (3S)-7-chloro-3-[(4-methoxyphenyl)methyl-[(1S)-1-phenylethyl]amino]heptanoic acid ethyl ester IUPAC Name: ethyl (3S)-7-chloro-3-[(4-methoxyphenyl)methyl-[(1S)-1-phenylethyl]amino]heptanoate Traditional Name: (3S)-7-chloro-3-[p-anisyl-[(1S)-1-phenylethyl]amino]enanthic acid ethyl ester Formula: C25H34ClNO3 MolecularWeight: 431.99536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CCCCCl)N(CC1=CC=C(C=C1)OC)C(C)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C[C@H](CCCCCl)N(CC1=CC=C(C=C1)OC)[C@@H](C)C2=CC=CC=C2

InChI

InChI=1S/C25H34ClNO3/c1-4-30-25(28)18-23(12-8-9-17-26)27(20(2)22-10-6-5-7-11-22)19-21-13-15-24(29-3)16-14-21/h5-7,10-11,13-16,20,23H,4,8-9,12,17-19H2,1-3H3/t20-,23-/m0/s1