(E)-4-[[(2S)-butan-2-yl]-[(4-propan-2-ylphenyl)methyl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[[(2S)-butan-2-yl]-[(4-propan-2-ylphenyl)methyl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[(4-isopropylphenyl)methyl-[(1S)-1-methylpropyl]amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[(2S)-butan-2-yl]-[(4-propan-2-ylphenyl)methyl]amino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[[(2S)-butan-2-yl]-[(4-propan-2-ylphenyl)methyl]amino]-4-oxobut-2-enoate Traditional Name: (E)-4-[(4-isopropylbenzyl)-[(1S)-1-methylpropyl]amino]-4-keto-but-2-enoate Formula: C18H24NO3- MolecularWeight: 302.38806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=C(C=C1)C(C)C)C(=O)C=CC(=O)[O-]

Isomeric SMILES

CC[C@H](C)N(CC1=CC=C(C=C1)C(C)C)C(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C18H25NO3/c1-5-14(4)19(17(20)10-11-18(21)22)12-15-6-8-16(9-7-15)13(2)3/h6-11,13-14H,5,12H2,1-4H3,(H,21,22)/p-1/b11-10+/t14-/m0/s1