3-(aminomethyl)-N-[(2S)-3-methyl-1-oxidanylidene-1-[[(2S)-4-oxidanyl-3-oxidanylidene-butan-2-yl]amino]pentan-2-yl]benzamide

Systemtic Name: 3-(aminomethyl)-N-[(2S)-3-methyl-1-oxidanylidene-1-[[(2S)-4-oxidanyl-3-oxidanylidene-butan-2-yl]amino]pentan-2-yl]benzamide Openeye Name: 3-(aminomethyl)-N-[(1S)-1-[[(1S)-3-hydroxy-1-methyl-2-oxo-propyl]carbamoyl]-2-methyl-butyl]benzamide CAS Name: 3-(aminomethyl)-N-[(2S)-1-[[(2S)-4-hydroxy-3-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]benzamide IUPAC Name: 3-(aminomethyl)-N-[(2S)-1-[[(2S)-4-hydroxy-3-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]benzamide Traditional Name: 3-(aminomethyl)-N-[(1S)-1-[[(1S)-3-hydroxy-2-keto-1-methyl-propyl]carbamoyl]-2-methyl-butyl]benzamide Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C)C(=O)CO)NC(=O)C1=CC(=CC=C1)CN

Isomeric SMILES

CCC(C)[C@@H](C(=O)N[C@@H](C)C(=O)CO)NC(=O)C1=CC(=CC=C1)CN

InChI

InChI=1S/C18H27N3O4/c1-4-11(2)16(18(25)20-12(3)15(23)10-22)21-17(24)14-7-5-6-13(8-14)9-19/h5-8,11-12,16,22H,4,9-10,19H2,1-3H3,(H,20,25)(H,21,24)/t11?,12-,16-/m0/s1