(3S)-5-chloranyl-3-[[(Z,2S)-1-cyclohexyl-6-methyl-hept-3-en-2-yl]carbamoyl]hex-5-enoic acid

Systemtic Name: (3S)-5-chloranyl-3-[[(Z,2S)-1-cyclohexyl-6-methyl-hept-3-en-2-yl]carbamoyl]hex-5-enoic acid Openeye Name: (3S)-5-chloro-3-[[(Z,1S)-1-(cyclohexylmethyl)-5-methyl-hex-2-enyl]carbamoyl]hex-5-enoic acid CAS Name: (3S)-5-chloro-3-[[[(Z,2S)-1-cyclohexyl-6-methylhept-3-en-2-yl]amino]-oxomethyl]-5-hexenoic acid IUPAC Name: (3S)-5-chloro-3-[[(Z,2S)-1-cyclohexyl-6-methylhept-3-en-2-yl]carbamoyl]hex-5-enoic acid Traditional Name: (3S)-5-chloro-3-[[(Z,1S)-1-(cyclohexylmethyl)-5-methyl-hex-2-enyl]carbamoyl]hex-5-enoic acid Formula: C21H34ClNO3 MolecularWeight: 383.95256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC=CC(CC1CCCCC1)NC(=O)C(CC(=C)Cl)CC(=O)O

Isomeric SMILES

CC(C)C/C=C\[C@H](CC1CCCCC1)NC(=O)[C@H](CC(=C)Cl)CC(=O)O

InChI

InChI=1S/C21H34ClNO3/c1-15(2)8-7-11-19(13-17-9-5-4-6-10-17)23-21(26)18(12-16(3)22)14-20(24)25/h7,11,15,17-19H,3-6,8-10,12-14H2,1-2H3,(H,23,26)(H,24,25)/b11-7-/t18-,19-/m1/s1