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butane-1,4-diol; [4-[[4-(carboxyamino)phenyl]methyl]phenyl]carbamic acid

butane-1,4-diol; [4-[[4-(carboxyamino)phenyl]methyl]phenyl]carbamic acid

Systemtic Name:butane-1,4-diol; [4-[[4-(carboxyamino)phenyl]methyl]phenyl]carbamic acid
Openeye Name:butane-1,4-diol; [4-[[4-(carboxyamino)phenyl]methyl]phenyl]carbamic acid
CAS Name:butane-1,4-diol; [4-[[4-(carboxyamino)phenyl]methyl]phenyl]carbamic acid
IUPAC Name:butane-1,4-diol; [4-[[4-(carboxyamino)phenyl]methyl]phenyl]carbamic acid
Traditional Name:butane-1,4-diol; [4-[4-(carboxyamino)benzyl]phenyl]carbamic acid
Formula: C19H24N2O6
MolecularWeight: 376.40366
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=C(C=C2)NC(=O)O)NC(=O)O.C(CCO)CO


Isomeric SMILES

C1=CC(=CC=C1CC2=CC=C(C=C2)NC(=O)O)NC(=O)O.C(CCO)CO


InChI

InChI=1S/C15H14N2O4.C4H10O2/c18-14(19)16-12-5-1-10(2-6-12)9-11-3-7-13(8-4-11)17-15(20)21;5-3-1-2-4-6/h1-8,16-17H,9H2,(H,18,19)(H,20,21);5-6H,1-4H2


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