2-[aminocarbonyl-[2-[3-(phenylmethoxymethyl)imidazol-4-yl]ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[aminocarbonyl-[2-[3-(phenylmethoxymethyl)imidazol-4-yl]ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[2-[3-(benzyloxymethyl)imidazol-4-yl]ethyl-carbamoyl-amino]-4-methyl-pentanoic acid CAS Name: 2-[carbamoyl-[2-[3-(phenylmethoxymethyl)-4-imidazolyl]ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carbamoyl-[2-[3-(phenylmethoxymethyl)imidazol-4-yl]ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[2-[3-(benzoxymethyl)imidazol-4-yl]ethyl-carbamoyl-amino]-4-methyl-valeric acid Formula: C20H28N4O4 MolecularWeight: 388.46072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CN=CN1COCC2=CC=CC=C2)C(=O)N

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CN=CN1COCC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C20H28N4O4/c1-15(2)10-18(19(25)26)24(20(21)27)9-8-17-11-22-13-23(17)14-28-12-16-6-4-3-5-7-16/h3-7,11,13,15,18H,8-10,12,14H2,1-2H3,(H2,21,27)(H,25,26)