2-[[6-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-2-yl]carbonylamino]-2-cyclohexyl-propanoic acid

Systemtic Name: 2-[[6-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-2-yl]carbonylamino]-2-cyclohexyl-propanoic acid Openeye Name: 2-[[2-(aminomethyl)tetralin-6-carbonyl]amino]-2-cyclohexyl-propanoic acid CAS Name: 2-[[[6-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-2-yl]-oxomethyl]amino]-2-cyclohexylpropanoic acid IUPAC Name: 2-[[6-(aminomethyl)-5,6,7,8-tetrahydronaphthalene-2-carbonyl]amino]-2-cyclohexylpropanoic acid Traditional Name: 2-[[2-(aminomethyl)tetralin-6-carbonyl]amino]-2-cyclohexyl-propionic acid Formula: C21H30N2O3 MolecularWeight: 358.4745

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)(C(=O)O)NC(=O)C2=CC3=C(CC(CC3)CN)C=C2

Isomeric SMILES

CC(C1CCCCC1)(C(=O)O)NC(=O)C2=CC3=C(CC(CC3)CN)C=C2

InChI

InChI=1S/C21H30N2O3/c1-21(20(25)26,18-5-3-2-4-6-18)23-19(24)17-10-9-15-11-14(13-22)7-8-16(15)12-17/h9-10,12,14,18H,2-8,11,13,22H2,1H3,(H,23,24)(H,25,26)