azane; methyl 2-azanyl-3-[4-(1-phenylpentan-2-yloxy)phenyl]propanoate

Systemtic Name: azane; methyl 2-azanyl-3-[4-(1-phenylpentan-2-yloxy)phenyl]propanoate Openeye Name: ammonia; methyl 2-amino-3-[4-(1-benzylbutoxy)phenyl]propanoate CAS Name: 2-amino-3-[4-(1-phenylpentan-2-yloxy)phenyl]propanoic acid methyl ester; ammonia IUPAC Name: azane; methyl 2-amino-3-[4-(1-phenylpentan-2-yloxy)phenyl]propanoate Traditional Name: 2-amino-3-[4-(1-benzylbutoxy)phenyl]propionic acid methyl ester; ammonia Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC=CC=C1)OC2=CC=C(C=C2)CC(C(=O)OC)N.N

Isomeric SMILES

CCCC(CC1=CC=CC=C1)OC2=CC=C(C=C2)CC(C(=O)OC)N.N

InChI

InChI=1S/C21H27NO3.H3N/c1-3-7-19(14-16-8-5-4-6-9-16)25-18-12-10-17(11-13-18)15-20(22)21(23)24-2;/h4-6,8-13,19-20H,3,7,14-15,22H2,1-2H3;1H3