methyl (2S)-2-azanyl-7-phenyl-hept-6-ynoate

Systemtic Name: methyl (2S)-2-azanyl-7-phenyl-hept-6-ynoate Openeye Name: methyl (2S)-2-amino-7-phenyl-hept-6-ynoate CAS Name: (2S)-2-amino-7-phenyl-6-heptynoic acid methyl ester IUPAC Name: methyl (2S)-2-amino-7-phenylhept-6-ynoate Traditional Name: (2S)-2-amino-7-phenyl-hept-6-ynoic acid methyl ester Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCC#CC1=CC=CC=C1)N

Isomeric SMILES

COC(=O)[C@H](CCCC#CC1=CC=CC=C1)N

InChI

InChI=1S/C14H17NO2/c1-17-14(16)13(15)11-7-3-6-10-12-8-4-2-5-9-12/h2,4-5,8-9,13H,3,7,11,15H2,1H3/t13-/m0/s1