phenyl 4-(2-azanylethyl)-1,4-diazepane-1-carboxylate

Systemtic Name: phenyl 4-(2-azanylethyl)-1,4-diazepane-1-carboxylate Openeye Name: phenyl 4-(2-aminoethyl)-1,4-diazepane-1-carboxylate CAS Name: 4-(2-aminoethyl)-1,4-diazepane-1-carboxylic acid phenyl ester IUPAC Name: phenyl 4-(2-aminoethyl)-1,4-diazepane-1-carboxylate Traditional Name: 4-(2-aminoethyl)-1,4-diazepane-1-carboxylic acid phenyl ester Formula: C14H21N3O2 MolecularWeight: 263.33544

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)OC2=CC=CC=C2)CCN

Isomeric SMILES

C1CN(CCN(C1)C(=O)OC2=CC=CC=C2)CCN

InChI

InChI=1S/C14H21N3O2/c15-7-10-16-8-4-9-17(12-11-16)14(18)19-13-5-2-1-3-6-13/h1-3,5-6H,4,7-12,15H2