methyl 1-[[(E,3R,4S)-1-cyclopropyl-4-oxidanyl-5-phenyl-pent-1-en-3-yl]-prop-2-ynyl-amino]cyclopentane-1-carboxylate

Systemtic Name: methyl 1-[[(E,3R,4S)-1-cyclopropyl-4-oxidanyl-5-phenyl-pent-1-en-3-yl]-prop-2-ynyl-amino]cyclopentane-1-carboxylate Openeye Name: methyl 1-[[(E,1R)-3-cyclopropyl-1-[(1S)-1-hydroxy-2-phenyl-ethyl]allyl]-prop-2-ynyl-amino]cyclopentanecarboxylate CAS Name: 1-[[(E,3R,4S)-1-cyclopropyl-4-hydroxy-5-phenylpent-1-en-3-yl]-prop-2-ynylamino]-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[(E,3R,4S)-1-cyclopropyl-4-hydroxy-5-phenylpent-1-en-3-yl]-prop-2-ynylamino]cyclopentane-1-carboxylate Traditional Name: 1-[[(E,1R)-3-cyclopropyl-1-[(1S)-1-hydroxy-2-phenyl-ethyl]allyl]-propargyl-amino]cyclopentanecarboxylic acid methyl ester Formula: C24H31NO3 MolecularWeight: 381.50784

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCC1)N(CC#C)C(C=CC2CC2)C(CC3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C1(CCCC1)N(CC#C)[C@H](/C=C/C2CC2)[C@H](CC3=CC=CC=C3)O

InChI

InChI=1S/C24H31NO3/c1-3-17-25(24(23(27)28-2)15-7-8-16-24)21(14-13-19-11-12-19)22(26)18-20-9-5-4-6-10-20/h1,4-6,9-10,13-14,19,21-22,26H,7-8,11-12,15-18H2,2H3/b14-13+/t21-,22+/m1/s1